@phdthesis{Theilmann2011, author = {Theilmann, Florian}, title = {Die Kunst der Untersuchung : Essays zu einem erscheinungsorientierten Physikunterricht}, url = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus-56145}, school = {Universit{\"a}t Potsdam}, year = {2011}, abstract = {Die vorliegende Arbeit versammelt zwei einleitende Kapitel und zehn Essays, die sich als kritisch-konstruktive Beitr{\"a}ge zu einem "erlebenden Verstehen" (Buck) von Physik lesen lassen. Die traditionelle Anlage von Schulphysik zielt auf eine systematische Darstellung naturwissenschaftlichen Wissens, das dann an ausgew{\"a}hlten Beispielen angewendet wird: Schulexperimente beweisen die Aussagen der Systematik (oder machen sie wenigstens plausibel), ausgew{\"a}hlte Ph{\"a}nomene werden erkl{\"a}rt. In einem solchen Rahmen besteht jedoch leicht die Gefahr, den Bezug zur Lebenswirklichkeit oder den Interessen der Sch{\"u}ler zu verlieren. Diese Problematik ist seit mindestens 90 Jahren bekannt, didaktische Antworten - untersuchendes Lernen, Kontextualisierung, Sch{\"u}lerexperimente etc. - adressieren allerdings eher Symptome als Ursachen. Naturwissenschaft wird dadurch spannend, dass sie ein spezifisch investigatives Weltverh{\"a}ltnis stiftet: man m{\"u}sste gleichsam nicht Wissen, sondern "Fragen lernen" (und nat{\"u}rlich auch, wie Antworten gefunden werden...). Doch wie kann dergleichen auf dem Niveau von Schulphysik aussehen, was f{\"u}r einen theoretischen Rahmen kann es hier geben? In den gesammelten Arbeiten wird einigen dieser Spuren nachgegangen: Der Absage an das zu modellhafte Denken in der ph{\"a}nomenologischen Optik, der Abgrenzung formal-mathematischen Denkens gegen wirklichkeitsn{\"a}here Formen naturwissenschaftlicher Denkbewegungen und Evidenz, dem Potential alternativer Interpretationen von "Physikunterricht", der Frage nach dem "Verstehen" u.a. Dabei werden nicht nur Bez{\"u}ge zum modernen bildungstheoretischen Paradigma der Kompetenz sichtbar, sondern es wird auch versucht, eine ganze Reihe konkrete (schul-)physikalische Beispiele daf{\"u}r zu geben, was passiert, wenn nicht schon gewusste Antworten Thema werden, sondern Expeditionen, die sich der physischen Welt widmen: Die Schl{\"u}sselbegriffe des Fachs, die Methoden der Datenerhebung und Interpretation, die Such- und Denkbewegungen kommen dabei auf eine Weise zur Sprache, die sich nicht auf die Fachsystematik abst{\"u}tzen m{\"o}chte, sondern diese motivieren, konturieren und verst{\"a}ndlich machen will.}, language = {de} } @phdthesis{Theves2013, author = {Theves, Matthias}, title = {Bacterial motility and growth in open and confined environments}, url = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus-70313}, school = {Universit{\"a}t Potsdam}, year = {2013}, abstract = {In the presence of a solid-liquid or liquid-air interface, bacteria can choose between a planktonic and a sessile lifestyle. Depending on environmental conditions, cells swimming in close proximity to the interface can irreversibly attach to the surface and grow into three-dimensional aggregates where the majority of cells is sessile and embedded in an extracellular polymer matrix (biofilm). We used microfluidic tools and time lapse microscopy to perform experiments with the polarly flagellated soil bacterium Pseudomonas putida (P. putida), a bacterial species that is able to form biofilms. We analyzed individual trajectories of swimming cells, both in the bulk fluid and in close proximity to a glass-liquid interface. Additionally, surface related growth during the early phase of biofilm formation was investigated. In the bulk fluid, P.putida shows a typical bacterial swimming pattern of alternating periods of persistent displacement along a line (runs) and fast reorientation events (turns) and cells swim with an average speed around 24 micrometer per second. We found that the distribution of turning angles is bimodal with a dominating peak around 180 degrees. In approximately six out of ten turning events, the cell reverses its swimming direction. In addition, our analysis revealed that upon a reversal, the cell systematically changes its swimming speed by a factor of two on average. Based on the experimentally observed values of mean runtime and rotational diffusion, we presented a model to describe the spreading of a population of cells by a run-reverse random walker with alternating speeds. We successfully recover the mean square displacement and, by an extended version of the model, also the negative dip in the directional autocorrelation function as observed in the experiments. The analytical solution of the model demonstrates that alternating speeds enhance a cells ability to explore its environment as compared to a bacterium moving at a constant intermediate speed. As compared to the bulk fluid, for cells swimming near a solid boundary we observed an increase in swimming speed at distances below d= 5 micrometer and an increase in average angular velocity at distances below d= 4 micrometer. While the average speed was maximal with an increase around 15\% at a distance of d= 3 micrometer, the angular velocity was highest in closest proximity to the boundary at d=1 micrometer with an increase around 90\% as compared to the bulk fluid. To investigate the swimming behavior in a confinement between two solid boundaries, we developed an experimental setup to acquire three-dimensional trajectories using a piezo driven objective mount coupled to a high speed camera. Results on speed and angular velocity were consistent with motility statistics in the presence of a single boundary. Additionally, an analysis of the probability density revealed that a majority of cells accumulated near the upper and lower boundaries of the microchannel. The increase in angular velocity is consistent with previous studies, where bacteria near a solid boundary were shown to swim on circular trajectories, an effect which can be attributed to a wall induced torque. The increase in speed at a distance of several times the size of the cell body, however, cannot be explained by existing theories which either consider the drag increase on cell body and flagellum near a boundary (resistive force theory) or model the swimming microorganism by a multipole expansion to account for the flow field interaction between cell and boundary. An accumulation of swimming bacteria near solid boundaries has been observed in similar experiments. Our results confirm that collisions with the surface play an important role and hydrodynamic interactions alone cannot explain the steady-state accumulation of cells near the channel walls. Furthermore, we monitored the number growth of cells in the microchannel under medium rich conditions. We observed that, after a lag time, initially isolated cells at the surface started to grow by division into colonies of increasing size, while coexisting with a comparable smaller number of swimming cells. After 5:50 hours, we observed a sudden jump in the number of swimming cells, which was accompanied by a breakup of bigger clusters on the surface. After approximately 30 minutes where planktonic cells dominated in the microchannel, individual swimming cells reattached to the surface. We interpret this process as an emigration and recolonization event. A number of complementary experiments were performed to investigate the influence of collective effects or a depletion of the growth medium on the transition. Similar to earlier observations on another bacterium from the same family we found that the release of cells to the swimming phase is most likely the result of an individual adaption process, where syntheses of proteins for flagellar motility are upregulated after a number of division cycles at the surface.}, language = {en} } @phdthesis{Thiede2019, author = {Thiede, Tobias}, title = {A multiscale analysis of additively manufactured lattice structures}, doi = {10.25932/publishup-47041}, url = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-470418}, school = {Universit{\"a}t Potsdam}, pages = {xi, 97, LIII}, year = {2019}, abstract = {Additive Manufacturing (AM) in terms of laser powder-bed fusion (L-PBF) offers new prospects regarding the design of parts and enables therefore the production of lattice structures. These lattice structures shall be implemented in various industrial applications (e.g. gas turbines) for reasons of material savings or cooling channels. However, internal defects, residual stress, and structural deviations from the nominal geometry are unavoidable. In this work, the structural integrity of lattice structures manufactured by means of L-PBF was non-destructively investigated on a multiscale approach. A workflow for quantitative 3D powder analysis in terms of particle size, particle shape, particle porosity, inter-particle distance and packing density was established. Synchrotron computed tomography (CT) was used to correlate the packing density with the particle size and particle shape. It was also observed that at least about 50\% of the powder porosity was released during production of the struts. Struts are the component of lattice structures and were investigated by means of laboratory CT. The focus was on the influence of the build angle on part porosity and surface quality. The surface topography analysis was advanced by the quantitative characterisation of re-entrant surface features. This characterisation was compared with conventional surface parameters showing their complementary information, but also the need for AM specific surface parameters. The mechanical behaviour of the lattice structure was investigated with in-situ CT under compression and successive digital volume correlation (DVC). The deformation was found to be knot-dominated, and therefore the lattice folds unit cell layer wise. The residual stress was determined experimentally for the first time in such lattice structures. Neutron diffraction was used for the non-destructive 3D stress investigation. The principal stress directions and values were determined in dependence of the number of measured directions. While a significant uni-axial stress state was found in the strut, a more hydrostatic stress state was found in the knot. In both cases, strut and knot, seven directions were at least needed to find reliable principal stress directions.}, language = {en} } @article{ThiedeCabezaMishurovaetal.2018, author = {Thiede, Tobias and Cabeza, Sandra and Mishurova, Tatiana and Nadammal, Naresh and Kromm, Arne and Bode, Johannes and Haberland, Christoph and Bruno, Giovanni}, title = {Residual Stress in Selective Laser Melted Inconel 718}, series = {Materials performance and characterization}, volume = {7}, journal = {Materials performance and characterization}, number = {4}, publisher = {American Society for Testing and Materials}, address = {West Conshohocken}, issn = {2379-1365}, doi = {10.1520/MPC20170119}, pages = {717 -- 735}, year = {2018}, abstract = {The residual stress distribution in IN718 elongated prisms produced by selective laser melting was studied by means of neutron (bulk) and laboratory X-ray (surface) diffraction. Two deposition hatch lengths were considered. A horizontal plane near the top surface (perpendicular to the building direction) and a vertical plane near the lateral surface (parallel to the building direction) were investigated. Samples both in as-built (AB) condition and removed from the base plate (RE) were characterized. While surface stress fields seem constant for the AB condition, X-ray diffraction shows stress gradients along the hatch direction in the RE condition. The stress profiles correlate with the distortion maps obtained by tactile probe measurements. Neutron diffraction shows bulk stress gradients for all principal components along the main sample directions. We correlate the observed stress patterns with the hatch length, i.e., with its effect on temperature gradients and heat flow. The bulk stress gradients partially disappear after removal from the base plate.}, language = {en} } @phdthesis{Thiel2004, author = {Thiel, Marco}, title = {Recurrences : exploiting naturally occurring analogues}, url = {http://nbn-resolving.de/urn:nbn:de:kobv:517-0001633}, school = {Universit{\"a}t Potsdam}, year = {2004}, abstract = {In der vorliegenden Arbeit wird die Wiederkehr im Phasenraum ausgenutzt. Dabei werden drei Hauptresultate besprochen. 1. Die Wiederkehr erlaubt die Vorhersagbarkeit des Systems zu quantifizieren. 2. Die Wiederkehr enthaelt (unter bestimmten Voraussetzungen) s{\"a}mtliche relevante Information {\"u}ber die Dynamik im Phasenraum 3. Die Wiederkehr erlaubt die Erzeugung dynamischer Ersatzdaten.}, language = {en} } @phdthesis{ThielemannKuehn2017, author = {Thielemann-K{\"u}hn, Nele}, title = {Optically induced ferro- and antiferromagnetic dynamics in the rare-earth metal dysprosium}, url = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-402994}, school = {Universit{\"a}t Potsdam}, pages = {iv, 121}, year = {2017}, abstract = {Approaching physical limits in speed and size of today's magnetic storage and processing technologies demands new concepts for controlling magnetization and moves researches on optically induced magnetic dynamics. Studies on photoinduced magnetization dynamics and their underlying mechanisms have been primarily performed on ferromagnetic metals. Ferromagnetic dynamics bases on transfer of the conserved angular momentum connected with atomic magnetic moments out of the parallel aligned magnetic system into other degrees of freedom. In this thesis the so far rarely studied response of antiferromagnetic order to ultra-short optical laser pulses in a metal is investigated. The experiments were performed at the FemtoSpex slicing facility at the storage ring BESSY II, an unique source for ultra-short elliptically polarized x-ray pulses. Laser-induced changes of the 4f-magnetic order parameter in ferro- and antiferromagnetic dysprosium (Dy), were studied by x-ray methods, which yield directly comparable quantities. The discovered fundamental differences in the temporal and spatial behavior of ferro- and antiferrmagnetic dynamics are assinged to an additional channel for angular momentum transfer, which reduces the antiferromagnetic order by redistributing angular momentum within the non-parallel aligned magnetic system, and hence conserves the zero net magnetization. It is shown that antiferromagnetic dynamics proceeds considerably faster and more energy-efficient than demagnetization in ferromagnets. By probing antiferromagnetic order in time and space, it is found to be affected along the whole sample depth of an in situ grown 73 nm tick Dy film. Interatomic transfer of angular momentum via fast diffusion of laser-excited 5d electrons is held responsible for the out-most long-ranging effect. Ultrafast ferromagnetic dynamics can be expected to base on the same origin, which however leads to demagnetization only in regions close to interfaces caused by super-diffusive spin transport. Dynamics due to local scattering processes of excited but less mobile electrons, occur in both magnetic alignments only in directly excited regions of the sample and on slower pisosecond timescales. The thesis provides fundamental insights into photoinduced magnetic dynamics by directly comparing ferro- and antiferromagnetic dynamics in the same material and by consideration of the laser-induced magnetic depth profile.}, language = {en} } @unpublished{ThiessenhusenEspositoKurthsetal.1995, author = {Thiessenhusen, Kai-Uwe and Esposito, Larry W. and Kurths, J{\"u}rgen and Spahn, Frank}, title = {Detection of hidden resonances in Saturn's B-ring}, url = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus-13618}, year = {1995}, abstract = {The Voyager 2 Photopolarimeter experiment has yielded the highest resolved data of Saturn's rings, exhibiting a wide variety of features. The B-ring region between 105000 km and 110000 km distance from Saturn has been investigated. It has a high matter density and contains no significance features visible by eye. Analysis with statistical methods has let us to the detection of two significant events. These features are correlated with the inner 3:2 resonances of the F-ring shepherd satellites Pandora and Prometheus, and may be evidence of large ring paricles caught in the corotation resonances.}, language = {en} } @misc{ThoelertHoermannAntreichetal.2017, author = {Thoelert, Steffen and H{\"o}rmann, Ulrich and Antreich, Felix and Meurer, Michael}, title = {Ionospheric effects on high gain antenna GNSS measurements}, series = {Proceedings of the 30th International Technical Meeting of the Satellite Division of The Institute of Navigation (ION GNSS+ 2017)}, journal = {Proceedings of the 30th International Technical Meeting of the Satellite Division of The Institute of Navigation (ION GNSS+ 2017)}, publisher = {Instituite of Navigation}, address = {Washington}, issn = {2331-5911}, doi = {10.33012/2017.15343}, pages = {3368 -- 3374}, year = {2017}, abstract = {The ionospheric delay of global navigation satellite systems (GNSS) signals typically is compensated by adding a single correction value to the pseudorange measurement of a GNSS receiver. Yet, this neglects the dispersive nature of the ionosphere. In this context we analyze the ionospheric signal distortion beyond a constant delay. These effects become increasingly significant with the signal bandwidth and hence more important for new broadband navigation signals. Using measurements of the Galileo E5 signal, captured with a high gain antenna, we verify that the expected influence can indeed be observed and compensated. A new method to estimate the total electron content (TEC) from a single frequency high gain antenna measurement of a broadband GNSS signal is proposed and described in detail. The received signal is de facto unaffected by multi-path and interference because of the narrow aperture angle of the used antenna which should reduce the error source of the result in general. We would like to point out that such measurements are independent of code correlation, like in standard receiver applications. It is therefore also usable without knowledge of the signal coding. Results of the TEC estimation process are shown and discussed comparing to common TEC products like TEC maps and dual frequency receiver estimates.}, language = {en} } @inproceedings{ThonigGilmanovaZhanetal.2022, author = {Thonig, Richard and Gilmanova, Alina and Zhan, Jing and Lilliestam, Johan}, title = {Chinese CSP for the world?}, series = {AIP conference proceedings}, booktitle = {AIP conference proceedings}, publisher = {American Institute of Physics}, address = {Melville}, issn = {1551-7616}, doi = {10.1063/5.0085752}, pages = {1 -- 11}, year = {2022}, abstract = {For three consecutive five-year plans since 2006, China has worked on building up an internationally competitive CSP industry and value chain. One big milestone in commercializing proprietary Chinese CSP technology was the 2016 demonstration program of 20 commercial-scale projects. China sought to increase and demonstrate capacities for domestic CSP technology development and deployment. At the end of the 13th five-year period, we take stock of the demonstrated progress of the Chinese CSP industry towards delivering internationally competitive CSP projects. We find that in January 2021, eight commercial-scale projects, in total 500 MW, have been completed and three others were under construction in China. In addition, Chinese EPC's have participated in three international CSP projects, although proprietary Chinese CSP designs have not been applied outside China. The largest progress has been made in molten-salt tower technology, with several projects by different companies completed and operating successfully: here, the aims were met, and Chinese companies are now at the global forefront of this segment. Further efforts for large-scale demonstration are needed, however, for other CSP technologies, including parabolic trough - with additional demonstration hindered by a lack of further deployment policies. In the near future, Chinese companies seek to employ the demonstrated capabilities in the tower segment abroad and are developing projects using Chinese technology, financing, and components in several overseas markets. If successful, this will likely lead to increasing competition and further cost reductions for the global CSP sector.}, language = {en} } @article{ThonigLilliestam2023, author = {Thonig, Richard and Lilliestam, Johan}, title = {Concentrating solar technology policy should encourage high temperatures and modularity to enable spillovers}, series = {AIP conference proceedings}, journal = {AIP conference proceedings}, number = {1}, publisher = {American Institute of Physics}, address = {Melville}, issn = {1551-7616}, doi = {10.1063/5.0149423}, pages = {1 -- 11}, year = {2023}, abstract = {Thermal energy from concentrating solar thermal technologies (CST) may contribute to decarbonizing applications from heating and cooling, desalination, and power generation to commodities such as aluminium, hydrogen, ammonia or sustainable aviation fuels (SAF). So far, successful commercial-scale CST projects are restricted to solar industrial process heat (SIPH) and concentrating solar power (CSP) generation and, at least for the latter, depend on support from public policies that have been stagnating for years. As they are technologically similar, spillovers between SIPH or CSP and other emerging CST could accelerate commercialization across use cases while maximizing the impact of scarce support. Here, we review the technical potential for cross-fertilization between different CST applications and the ability of the current policy regime to enable this potential. Using working temperature as the key variable, we identify different clusters of current and emerging CST technologies. Low-temperature CST (<400℃) applications for heating, cooling and desalination already profit from the significant progress made in line-focussing CSP over the last 15 years. A newly emerging cluster of high temperature CST (>600℃) for solar chemistry and high-grade process heat has significant leverage for spillovers with point-focussing solar tower third-generation CSP currently under development. For these spillovers to happen, however, CSP policy designs would need to prioritize innovation for high working temperature and encourage modular plant design, by adequately remunerating hybridized plants with heat and power in and outputs that include energy sources beyond CST solar fields. This would enable synergies across applications and scales by incentivizing compatibility of modular CST components in multiple sectors and use cases.}, language = {en} } @article{TianLiang2022, author = {Tian, Peibo and Liang, Yingjie}, title = {Material coordinate driven variable-order fractal derivative model of water anomalous adsorption in swelling soil}, series = {Chaos, solitons \& fractals}, volume = {164}, journal = {Chaos, solitons \& fractals}, publisher = {Elsevier}, address = {Oxford}, issn = {0960-0779}, doi = {10.1016/j.chaos.2022.112754}, pages = {8}, year = {2022}, abstract = {The diffusion process of water in swelling (expansive) soil often deviates from normal Fick diffusion and belongs to anomalous diffusion. The process of water adsorption by swelling soil often changes with time, in which the microstructure evolves with time and the absorption rate changes along a fractal dimension gradient function. Thus, based on the material coordinate theory, this paper proposes a variable order derivative fractal model to describe the cumulative adsorption of water in the expansive soil, and the variable order is time dependent linearly. The cumulative adsorption is a power law function of the anomalous sorptivity, and patterns of the variable order. The variable-order fractal derivative model is tested to describe the cumulative adsorption in chernozemic surface soil, Wunnamurra clay and sandy loam. The results show that the fractal derivative model with linearly time dependent variable-order has much better accuracy than the fractal derivative model with a constant derivative order and the integer order model in the application cases. The derivative order can be used to distinguish the evolution of the anomalous adsorption process. The variable-order fractal derivative model can serve as an alternative approach to describe water anomalous adsorption in swelling soil.}, language = {en} } @phdthesis{Timpanaro2004, author = {Timpanaro, Salvatore}, title = {Conductive properties and morphology of conjugated molecular materials studied by local probe techniques}, url = {http://nbn-resolving.de/urn:nbn:de:kobv:517-0001929}, school = {Universit{\"a}t Potsdam}, year = {2004}, abstract = {Die vorgelegte Arbeit befasst sich mit der Untersuchung von Zusammenh{\"a}ngen zwischen der Struktur d{\"u}nner organischer Schichten und stellt einen Bezug zur Leitf{\"a}higkeit der Schichten her. Sie liefert einen Beitrag zum vertieften Verst{\"a}ndnis der Transporteigenschaf-ten organischer Halbleiter und soll so zur Verbesserung organischer elektronischer Bauele-mente beitragen. Es ist bekannt, dass die Effizienz von Organischen Leuchtdioden (OLEDs) stark von der Qualit{\"a}t der eingesetzten d{\"u}nnen Filme abh{\"a}ngt. Es ist deshalb interessant, die Strukturen technologisch interessanter organischer Filme mittels Scanning Probe Mikrosko-pie (SPM) zu charakterisieren, um ein besseres Verst{\"a}ndnis sowohl der Oberfl{\"a}chen-Morphologie als auch der molekularen/atomaren Packungen zu erhalten. Die Untersuchung von Quaterthiophen (4T), welches vielfach in Feldeffekt-Transistoren eingesetzt wird, bildet einen ersten Schwerpunkt der Arbeit. Es konnte eine neue Kristall-struktur von 4T gefunden werden, die bisher nicht bekannt war. Daf{\"u}r wurden Quaterthi-ophen-Filme untersucht, welche auf Kaliumphthalat (KAP) aufwuchsen. Die Aufkl{\"a}rung der neuen Struktur gelang durch Kombinierten Einsatz von optischen und R{\"o}ntgen-Beugungsmessungen. Zur Best{\"a}tigung der triklinen Kristall-Einheitszelle mit den Parame-tern a = 0,721 nm, b = 0,632 nm, c = 0,956 nm und α = 91o, β = 91,4o, γ = 91o wurde außer-dem die Atomkraft-Mikroskopie (AFM) angewendet. In Fortf{\"u}hrung der rastermikroskopischen Messungen sind die Morphologien von Filmen vier weiterer organischer Materialien technologischer Relevanz untersucht worden: He-xanthiol-Monoschichten auf Gold, Azobenzenthiol-Monoschichten auf Gold, Para-Phenylenvinylen-Oligomer-Filme auf Gold und Phenyl-Oxadiazol-Filme auf Gold. Daf{\"u}r kam zus{\"a}tzlich die Ultrahochvakuum-Scanning-Tunneling-Mikroskopie (UHV-STM) zum Einsatz. Es zeigte sich eine Vielzahl morphologischer Eigenheiten, deren Besonderheiten sowohl von den gew{\"a}hlten Substraten als auch von der chemischen Struktur der untersuchten organischen Materialien abh{\"a}ngen. So zeigen Para-Phenylenvinylen-Oligomer-Filme eine St{\"a}bchen- und Oxadiazol-Filme eine K{\"o}rnchen-Struktur auf Gold. Auf Basis dieser Kenntnisse gelang es, das optisch induzierte Schalten von Azobenzen durch STM-Untersuchungen und durch Scanning Tunneling Spektroskopie (STS) auf molekularer Skale nachzuweisen. Die Topographie einer Reihe von Poly(3,4-ethylendioxythiophen)-(PEDOT)-Filmen und de-ren Bezug zu den Ladungstransporteigenschaften dieser Filme war ein weiterer Arbeits-schwerpunkt. PEDOT-Filme auf Indium-Zinn-Oxid (ITO) kommen in organischen elektro-nischen Bauelementen als Lochinjektionsschichten zum Einsatz. F{\"u}r die Schichtherstellung kamen Dispersionen des Polymers unterschiedlicher Konzentration zur Anwendung: Mittels AFM und STM konnte gezeigt werden, dass unterschiedliche Konzentrationen zu unter-schiedlichen Topographien f{\"u}hren. Besonders die Oberfl{\"a}che der Filme mit hoher Konzent-ration von PEDOT, d.h. die der leitf{\"a}higsten Filme, wird durch eine k{\"o}rnchenartige Struktur eingebetteter Teilchen charakterisiert. Durch STM Strom-Abstands-(I-d)-Untersuchungen wurde gefunden, dass diese Teilchen die „Spitze eines Eisbergs" leitf{\"a}higer Dom{\"a}nen dar-stellen. Ausgehend von dieser Erkenntnis wird ein Strukturmodell f{\"u}r die Filme vorgeschla-gen, in dem die leitf{\"a}higen Dom{\"a}nen / Partikel in eine weniger leitf{\"a}hige Matrix eingebettet sind. Durch Zugabe von Polyolen wie Sorbitol zur PEDOT-Dispersion ließen sich Filme mit h{\"o}herer Leitf{\"a}higkeit herstellen. Eine klare Abh{\"a}ngigkeit zwischen der Leitf{\"a}higkeit und der bisher nicht beschrieben nano-Morphologie wurde gefunden.}, language = {en} } @article{ToalaBowmanVanReethetal.2022, author = {Toal{\´a}, Jes{\´u}s Alberto and Bowman, Dominic and Van Reeth, Timothy and Todt, Helge Tobias and Dsilva, Karan and Shenar, Tomer and Koenigsberger, Gloria Suzanne and Estrada-Dorado, Sandino and Oskinova, Lidia M. and Hamann, Wolf-Rainer}, title = {Multiple variability time-scales of the early nitrogen-rich Wolf-Rayet star WR 7}, series = {Monthly notices of the Royal Astronomical Society}, volume = {514}, journal = {Monthly notices of the Royal Astronomical Society}, number = {2}, publisher = {Oxford University Press}, address = {Oxford}, issn = {0035-8711}, doi = {10.1093/mnras/stac1455}, pages = {2269 -- 2277}, year = {2022}, abstract = {We present the analysis of the optical variability of the early, nitrogen-rich Wolf-Rayet (WR) star WR 7. The analysis of multisector Transiting Exoplanet Survey Satellite (TESS) light curves and high-resolution spectroscopic observations confirm multiperiodic variability that is modulated on time-scales of years. We detect a dominant period of 2.6433 +/- 0.0005 d in the TESS sectors 33 and 34 light curves in addition to the previously reported high-frequency features from sector 7. We discuss the plausible mechanisms that may be responsible for such variability in WR 7, including pulsations, binarity, co-rotating interaction regions (CIRs), and clumpy winds. Given the lack of strong evidence for the presence of a stellar or compact companion, we suggest that WR 7 may pulsate in quasi-coherent modes in addition to wind variability likely caused by CIRs on top of stochastic low-frequency variability. WR 7 is certainly a worthy target for future monitoring in both spectroscopy and photometry to sample both the short (less than or similar to 1 d) and long (greater than or similar to 1000 d) variability time-scales.}, language = {en} } @article{TockhornSutterCruzBournazouetal.2022, author = {Tockhorn, Philipp and Sutter, Johannes and Cruz Bournazou, Alexandros and Wagner, Philipp and J{\"a}ger, Klaus and Yoo, Danbi and Lang, Felix and Grischek, Max and Li, Bor and Li, Jinzhao and Shargaieva, Oleksandra and Unger, Eva and Al-Ashouri, Amran and K{\"o}hnen, Eike and Stolterfoht, Martin and Neher, Dieter and Schlatmann, Rutger and Rech, Bernd and Stannowski, Bernd and Albrecht, Steve and Becker, Christiane}, title = {Nano-optical designs for high-efficiency monolithic perovskite-silicon tandem solar cells}, series = {Nature nanotechnology}, volume = {17}, journal = {Nature nanotechnology}, number = {11}, publisher = {Nature Publishing Group}, address = {London [u.a.]}, issn = {1748-3387}, doi = {10.1038/s41565-022-01228-8}, pages = {1214 -- 1221}, year = {2022}, abstract = {Designing gentle sinusoidal nanotextures enables the realization of high-efficiency perovskite-silicon solar cells
Perovskite-silicon tandem solar cells offer the possibility of overcoming the power conversion efficiency limit of conventional silicon solar cells. Various textured tandem devices have been presented aiming at improved optical performance, but optimizing film growth on surface-textured wafers remains challenging. Here we present perovskite-silicon tandem solar cells with periodic nanotextures that offer various advantages without compromising the material quality of solution-processed perovskite layers. We show a reduction in reflection losses in comparison to planar tandems, with the new devices being less sensitive to deviations from optimum layer thicknesses. The nanotextures also enable a greatly increased fabrication yield from 50\% to 95\%. Moreover, the open-circuit voltage is improved by 15 mV due to the enhanced optoelectronic properties of the perovskite top cell. Our optically advanced rear reflector with a dielectric buffer layer results in reduced parasitic absorption at near-infrared wavelengths. As a result, we demonstrate a certified power conversion efficiency of 29.80\%.}, language = {en} } @article{TokmoldinHosseiniRaoufietal.2020, author = {Tokmoldin, Nurlan and Hosseini, Seyed Mehrdad and Raoufi, Meysam and Phuong, Le Quang and Sandberg, Oskar J. and Guan, Huilan and Zou, Yingping and Neher, Dieter and Shoaee, Safa}, title = {Extraordinarily long diffusion length in PM6:Y6 organic solar cells}, series = {Journal of materials chemistry : A, materials for energy and sustainability}, volume = {8}, journal = {Journal of materials chemistry : A, materials for energy and sustainability}, number = {16}, publisher = {Royal Society of Chemistry}, address = {Cambridge}, issn = {2050-7488}, doi = {10.1039/d0ta03016c}, pages = {7854 -- 7860}, year = {2020}, abstract = {The PM6:Y6 bulk-heterojunction (BHJ) blend system achieves high short-circuit current (J(SC)) values in thick photovoltaic junctions. Here we analyse these solar cells to understand the observed independence of the short-circuit current upon photoactive layer thickness. We employ a range of optoelectronic measurements and analyses, including Mott-Schottky analysis, CELIV, photoinduced absorption spectroscopy, mobility measurements and simulations, to conclude that, the invariant photocurrent for the devices with different active layer thicknesses is associated with the Y6's diffusion length exceeding 300 nm in case of a 300 nm thick cell. This is despite unintentional doping that occurs in PM6 and the associated space-charge effect, which is expected to be even more profound upon photogeneration. This extraordinarily long diffusion length - which is an order of magnitude larger than typical values for organics - dominates transport in the flat-band region of thick junctions. Our work suggests that the performance of the doped PM6:Y6 organic solar cells resembles that of inorganic devices with diffusion transport playing a pivotal role. Ultimately, this is expected to be a key requirement for the fabrication of efficient, high-photocurrent, thick organic solar cells.}, language = {en} } @phdthesis{Topaj2001, author = {Topaj, Dmitri}, title = {Synchronization transitions in complex systems}, url = {http://nbn-resolving.de/urn:nbn:de:kobv:517-0000367}, school = {Universit{\"a}t Potsdam}, year = {2001}, abstract = {Gegenstand dieser Arbeit ist die Untersuchung generischer Synchronisierungsph{\"a}nomene in interagierenden komplexen Systemen. Diese Ph{\"a}nomene werden u.a. in gekoppelten deterministischen chaotischen Systemen beobachtet. Bei sehr schwachen Interaktionen zwischen individuellen Systemen kann ein {\"U}bergang zum schwach koh{\"a}renten Verhalten der Systeme stattfinden. In gekoppelten zeitkontinuierlichen chaotischen Systemen manifestiert sich dieser {\"U}bergang durch den Effekt der Phasensynchronisierung, in gekoppelten chaotischen zeitdiskreten Systemen durch den Effekt eines nichtverschwindenden makroskopischen Feldes. Der {\"U}bergang zur Koh{\"a}renz in einer Kette lokal gekoppelter Oszillatoren, beschrieben durch Phasengleichungen, wird im Bezug auf die Symmetrien des Systems untersucht. Es wird gezeigt, daß die durch die Symmetrien verursachte Reversibilit{\"a}t des Systems nichttriviale topologische Eigenschaften der Trajektorien bedingt, so daß das als dissipativ konstruierte System in einem ganzen Parameterbereich quasi-Hamiltonische Z{\"u}ge aufweist, d.h. das Phasenvolumen ist im Schnitt erhalten, und die Lyapunov-Exponenten sind paarweise symmetrisch. Der {\"U}bergang zur Koh{\"a}renz in einem Ensemble global gekoppelter chaotischer Abbildungen wird durch den Verlust der Stabilit{\"a}t des entkoppelten Zustandes beschrieben. Die entwickelte Methode besteht darin, die Selbstkonsistenz des makroskopischen Feldes aufzuheben, und das Ensemble in Analogie mit einem Verst{\"a}rkerschaltkreis mit R{\"u}ckkopplung durch eine komplexe lineare {\"U}bertragungssfunktion zu charakterisieren. Diese Theorie wird anschließend f{\"u}r einige theoretisch interessanten F{\"a}lle verallgemeinert.}, language = {en} } @article{TorrejonReigFuerstetal.2018, author = {Torrejon, J. M. and Reig, Pablo and F{\"u}rst, F. and Martinez-Chicharro, M. and Postnov, K. and Oskinova, Lidia M.}, title = {NuSTAR rules out a cyclotron line in the accreting magnetar candidate 4U2206+54}, series = {Monthly notices of the Royal Astronomical Society}, volume = {479}, journal = {Monthly notices of the Royal Astronomical Society}, number = {3}, publisher = {Oxford Univ. Press}, address = {Oxford}, issn = {0035-8711}, doi = {10.1093/mnras/sty1628}, pages = {3366 -- 3372}, year = {2018}, abstract = {Based on our new NuSTAR X-ray telescope data, we rule out any cyclotron line up to 60 keV in the spectra of the high-mass X-ray binary 4U2206+54. In particular, we do not find any evidence of the previously claimed line around 30 keV, independently of the source flux, along the spin pulse. The spin period has increased significantly, since the last observation, up to 5750 +/- 10 s, confirming the rapid spin-down rate (nu)over dot = -1.8 x 10(-14) Hz s(-1). This behaviour might be explained by the presence of a strongly magnetized neutron star (B-s > several times 10(13) G) accreting from the slow wind of its main-sequence O9.5 companion.}, language = {en} } @article{TotzEliseevPetrietal.2018, author = {Totz, Sonja Juliana and Eliseev, Alexey V. and Petri, Stefan and Flechsig, Michael and Caesar, Levke and Petoukhov, Vladimir and Coumou, Dim}, title = {The dynamical core of the Aeolus 1.0 statistical-dynamical atmosphere model}, series = {Geoscientific model development : an interactive open access journal of the European Geosciences Union}, volume = {11}, journal = {Geoscientific model development : an interactive open access journal of the European Geosciences Union}, number = {2}, publisher = {Copernicus}, address = {G{\"o}ttingen}, issn = {1991-959X}, doi = {10.5194/gmd-11-665-2018}, pages = {665 -- 679}, year = {2018}, abstract = {Here, we present novel equations for the large-scale zonal-mean wind as well as those for planetary waves. Together with synoptic parameterization (as presented by Coumou et al., 2011), these form the mathematical description of the dynamical core of Aeolus 1.0. The regions of high azonal wind velocities (planetary waves) are accurately captured for all validation experiments. The zonal-mean zonal wind and the integrated lower troposphere mass flux show good results in particular in the Northern Hemisphere. In the Southern Hemisphere, the model tends to produce too-weak zonal-mean zonal winds and a too-narrow Hadley circulation. We discuss possible reasons for these model biases as well as planned future model improvements and applications.}, language = {en} } @misc{TotzLoeberTotzetal.2018, author = {Totz, Sonja Juliana and L{\"o}ber, Jakob and Totz, Jan Frederik and Engel, Harald}, title = {Control of transversal instabilities in reaction-diffusion systems}, series = {Postprints der Universit{\"a}t Potsdam : Mathematisch-Naturwissenschaftliche Reihe}, journal = {Postprints der Universit{\"a}t Potsdam : Mathematisch-Naturwissenschaftliche Reihe}, number = {962}, issn = {1866-8372}, doi = {10.25932/publishup-46976}, url = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-469762}, pages = {19}, year = {2018}, abstract = {In two-dimensional reaction-diffusion systems, local curvature perturbations on traveling waves are typically damped out and vanish. However, if the inhibitor diffuses much faster than the activator, transversal instabilities can arise, leading from flat to folded, spatio-temporally modulated waves and to spreading spiral turbulence. Here, we propose a scheme to induce or inhibit these instabilities via a spatio-temporal feedback loop. In a piecewise-linear version of the FitzHugh-Nagumo model, transversal instabilities and spiral turbulence in the uncontrolled system are shown to be suppressed in the presence of control, thereby stabilizing plane wave propagation. Conversely, in numerical simulations with the modified Oregonator model for the photosensitive Belousov-Zhabotinsky reaction, which does not exhibit transversal instabilities on its own, we demonstrate the feasibility of inducing transversal instabilities and study the emerging wave patterns in a well-controlled manner.}, language = {en} } @article{TotzLoeberTotzetal.2018, author = {Totz, Sonja Juliana and L{\"o}ber, Jakob and Totz, Jan Frederik and Engel, Harald}, title = {Control of transversal instabilities in reaction-diffusion systems}, series = {New journal of physics : the open-access journal for physics}, volume = {20}, journal = {New journal of physics : the open-access journal for physics}, publisher = {IOP Publ. Ltd.}, address = {Bristol}, issn = {1367-2630}, doi = {10.1088/1367-2630/aabce5}, pages = {16}, year = {2018}, abstract = {In two-dimensional reaction-diffusion systems, local curvature perturbations on traveling waves are typically damped out and vanish. However, if the inhibitor diffuses much faster than the activator, transversal instabilities can arise, leading from flat to folded, spatio-temporally modulated waves and to spreading spiral turbulence. Here, we propose a scheme to induce or inhibit these instabilities via a spatio-temporal feedback loop. In a piecewise-linear version of the FitzHugh-Nagumo model, transversal instabilities and spiral turbulence in the uncontrolled system are shown to be suppressed in the presence of control, thereby stabilizing plane wave propagation. Conversely, in numerical simulations with the modified Oregonator model for the photosensitive Belousov-Zhabotinsky reaction, which does not exhibit transversal instabilities on its own, we demonstrate the feasibility of inducing transversal instabilities and study the emerging wave patterns in a well-controlled manner.}, language = {en} } @phdthesis{Trabant2014, author = {Trabant, Christoph}, title = {Ultrafast photoinduced phase transitions in complex materials probed by time-resolved resonant soft x-ray diffraction}, url = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus-71377}, school = {Universit{\"a}t Potsdam}, year = {2014}, abstract = {In processing and data storage mainly ferromagnetic (FM) materials are being used. Approaching physical limits, new concepts have to be found for faster, smaller switches, for higher data densities and more energy efficiency. Some of the discussed new concepts involve the material classes of correlated oxides and materials with antiferromagnetic coupling. Their applicability depends critically on their switching behavior, i.e., how fast and how energy efficient material properties can be manipulated. This thesis presents investigations of ultrafast non-equilibrium phase transitions on such new materials. In transition metal oxides (TMOs) the coupling of different degrees of freedom and resulting low energy excitation spectrum often result in spectacular changes of macroscopic properties (colossal magneto resistance, superconductivity, metal-to-insulator transitions) often accompanied by nanoscale order of spins, charges, orbital occupation and by lattice distortions, which make these material attractive. Magnetite served as a prototype for functional TMOs showing a metal-to-insulator-transition (MIT) at T = 123 K. By probing the charge and orbital order as well as the structure after an optical excitation we found that the electronic order and the structural distortion, characteristics of the insulating phase in thermal equilibrium, are destroyed within the experimental resolution of 300 fs. The MIT itself occurs on a 1.5 ps timescale. It shows that MITs in functional materials are several thousand times faster than switching processes in semiconductors. Recently ferrimagnetic and antiferromagnetic (AFM) materials have become interesting. It was shown in ferrimagnetic GdFeCo, that the transfer of angular momentum between two opposed FM subsystems with different time constants leads to a switching of the magnetization after laser pulse excitation. In addition it was theoretically predicted that demagnetization dynamics in AFM should occur faster than in FM materials as no net angular momentum has to be transferred out of the spin system. We investigated two different AFM materials in order to learn more about their ultrafast dynamics. In Ho, a metallic AFM below T ≈ 130 K, we found that the AFM Ho can not only be faster but also ten times more energy efficiently destroyed as order in FM comparable metals. In EuTe, an AFM semiconductor below T ≈ 10 K, we compared the loss of magnetization and laser-induced structural distortion in one and the same experiment. Our experiment shows that they are effectively disentangled. An exception is an ultrafast release of lattice dynamics, which we assign to the release of magnetostriction. The results presented here were obtained with time-resolved resonant soft x-ray diffraction at the Femtoslicing source of the Helmholtz-Zentrum Berlin and at the free-electron laser in Stanford (LCLS). In addition the development and setup of a new UHV-diffractometer for these experiments will be reported.}, language = {en} } @article{TroendleLilliestamMarellietal.2020, author = {Tr{\"o}ndle, Tim and Lilliestam, Johan and Marelli, Stefano and Pfenninger, Stefan}, title = {Trade-offs between geographic scale, cost, and infrastructure requirements for fully renewable electricity in Europe}, series = {Joule}, volume = {4}, journal = {Joule}, number = {9}, publisher = {Cell Press}, address = {Cambridge , Mass.}, issn = {2542-4351}, doi = {10.1016/j.joule.2020.07.018}, pages = {1929 -- 1948}, year = {2020}, abstract = {The European potential for renewable electricity is sufficient to enable fully renewable supply on different scales, from self-sufficient, subnational regions to an interconnected continent. We not only show that a continental-scale system is the cheapest, but also that systems on the national scale and below are possible at cost penalties of 20\% or less. Transmission is key to low cost, but it is not necessary to vastly expand the transmission system. When electricity is transmitted only to balance fluctuations, the transmission grid size is comparable to today's, albeit with expanded cross-border capacities. The largest differences across scales concern land use and thus social acceptance: in the continental system, generation capacity is concentrated on the European periphery, where the best resources are. Regional systems, in contrast, have more dispersed generation. The key trade-off is therefore not between geographic scale and cost, but between scale and the spatial distribution of required generation and transmission infrastructure.}, language = {en} } @misc{TroendleLilliestamMarellietal.2020, author = {Tr{\"o}ndle, Tim and Lilliestam, Johan and Marelli, Stefano and Pfenninger, Stefan}, title = {Trade-offs between geographic scale, cost, and infrastructure requirements for fully renewable electricity in Europe}, series = {Postprints der Universit{\"a}t Potsdam Wirtschafts- und Sozialwissenschaftliche Reihe}, journal = {Postprints der Universit{\"a}t Potsdam Wirtschafts- und Sozialwissenschaftliche Reihe}, number = {9}, doi = {10.25932/publishup-53961}, url = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-539611}, pages = {1929 -- 1948}, year = {2020}, abstract = {The European potential for renewable electricity is sufficient to enable fully renewable supply on different scales, from self-sufficient, subnational regions to an interconnected continent. We not only show that a continental-scale system is the cheapest, but also that systems on the national scale and below are possible at cost penalties of 20\% or less. Transmission is key to low cost, but it is not necessary to vastly expand the transmission system. When electricity is transmitted only to balance fluctuations, the transmission grid size is comparable to today's, albeit with expanded cross-border capacities. The largest differences across scales concern land use and thus social acceptance: in the continental system, generation capacity is concentrated on the European periphery, where the best resources are. Regional systems, in contrast, have more dispersed generation. The key trade-off is therefore not between geographic scale and cost, but between scale and the spatial distribution of required generation and transmission infrastructure.}, language = {en} } @article{TubianaRinaldiGuettleretal.2019, author = {Tubiana, C. and Rinaldi, G. and Guettler, C. and Snodgrass, C. and Shi, X. and Hu, X. and Marschall, R. and Fulle, M. and Bockeele-Morvan, D. and Naletto, G. and Capaccioni, F. and Sierks, H. and Arnold, G. and Barucci, M. A. and Bertaux, J-L and Bertini, I and Bodewits, D. and Capria, M. T. and Ciarniello, M. and Cremonese, G. and Crovisier, J. and Da Deppo, V and Debei, S. and De Cecco, M. and Deller, J. and De Sanctis, M. C. and Davidsson, B. and Doose, L. and Erard, S. and Filacchione, G. and Fink, U. and Formisano, M. and Fornasier, S. and Gutierrez, P. J. and Ip, W-H and Ivanovski, S. and Kappel, David and Keller, H. U. and Kolokolova, L. and Koschny, D. and Krueger, H. and La Forgia, F. and Lamy, P. L. and Lara, L. M. and Lazzarin, M. and Levasseur-Regourd, A. C. and Lin, Z-Y and Longobardo, A. and Lopez-Moreno, J. J. and Marzari, F. and Migliorini, A. and Mottola, S. and Rodrigo, R. and Taylor, F. and Toth, I and Zakharov, V}, title = {Diurnal variation of dust and gas production in comet 67P/Churyumov-Gerasimenko at the inbound equinox as seen by OSIRIS and VIRTIS-M on board Rosetta}, series = {Astronomy and astrophysics : an international weekly journal}, volume = {630}, journal = {Astronomy and astrophysics : an international weekly journal}, publisher = {EDP Sciences}, address = {Les Ulis}, issn = {1432-0746}, doi = {10.1051/0004-6361/201834869}, pages = {14}, year = {2019}, abstract = {Context. On 27 April 2015, when comet 67P/Churyumov-Gerasimenko was at 1.76 au from the Sun and moving toward perihelion, the OSIRIS and VIRTIS-M instruments on board the Rosetta spacecraft simultaneously observed the evolving dust and gas coma during a complete rotation of the comet. Aims. We aim to characterize the spatial distribution of dust, H2O, and CO2 gas in the inner coma. To do this, we performed a quantitative analysis of the release of dust and gas and compared the observed H2O production rate with the rate we calculated using a thermophysical model. Methods. For this study we selected OSIRIS WAC images at 612 nm (dust) and VIRTIS-M image cubes at 612 nm, 2700 nm (H2O emission band), and 4200 nm (CO2 emission band). We measured the average signal in a circular annulus to study the spatial variation around the comet, and in a sector of the annulus to study temporal variation in the sunward direction with comet rotation, both at a fixed distance of 3.1 km from the comet center. Results. The spatial correlation between dust and water, both coming from the sunlit side of the comet, shows that water is the main driver of dust activity in this time period. The spatial distribution of CO2 is not correlated with water and dust. There is no strong temporal correlation between the dust brightness and water production rate as the comet rotates. The dust brightness shows a peak at 0 degrees subsolar longitude, which is not pronounced in the water production. At the same epoch, there is also a maximum in CO2 production. An excess of measured water production with respect to the value calculated using a simple thermophysical model is observed when the head lobe and regions of the southern hemisphere with strong seasonal variations are illuminated (subsolar longitude 270 degrees-50 degrees). A drastic decrease in dust production when the water production (both measured and from the model) displays a maximum occurs when typical northern consolidated regions are illuminated and the southern hemisphere regions with strong seasonal variations are instead in shadow (subsolar longitude 50 degrees-90 degrees). Possible explanations of these observations are presented and discussed.}, language = {en} } @phdthesis{Tukhlina2008, author = {Tukhlina, Natalia}, title = {Feedback control of complex oscillatory systems}, url = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus-18546}, school = {Universit{\"a}t Potsdam}, year = {2008}, abstract = {In the present dissertation paper an approach which ensures an efficient control of such diverse systems as noisy or chaotic oscillators and neural ensembles is developed. This approach is implemented by a simple linear feedback loop. The dissertation paper consists of two main parts. One part of the work is dedicated to the application of the suggested technique to a population of neurons with a goal to suppress their synchronous collective dynamics. The other part is aimed at investigating linear feedback control of coherence of a noisy or chaotic self-sustained oscillator. First we start with a problem of suppressing synchronization in a large population of interacting neurons. The importance of this task is based on the hypothesis that emergence of pathological brain activity in the case of Parkinson's disease and other neurological disorders is caused by synchrony of many thousands of neurons. The established therapy for the patients with such disorders is a permanent high-frequency electrical stimulation via the depth microelectrodes, called Deep Brain Stimulation (DBS). In spite of efficiency of such stimulation, it has several side effects and mechanisms underlying DBS remain unclear. In the present work an efficient and simple control technique is suggested. It is designed to ensure suppression of synchrony in a neural ensemble by a minimized stimulation that vanishes as soon as the tremor is suppressed. This vanishing-stimulation technique would be a useful tool of experimental neuroscience; on the other hand, control of collective dynamics in a large population of units represents an interesting physical problem. The main idea of suggested approach is related to the classical problem of oscillation theory, namely the interaction between a self-sustained (active) oscillator and a passive load (resonator). It is known that under certain conditions the passive oscillator can suppress the oscillations of an active one. In this thesis a much more complicated case of active medium, which itself consists of thousands of oscillators is considered. Coupling this medium to a specially designed passive oscillator, one can control the collective motion of the ensemble, specifically can enhance or suppress it. Having in mind a possible application in neuroscience, the problem of suppression is concentrated upon. Second, the efficiency of suggested suppression scheme is illustrated by considering more complex case, i.e. when the population of neurons generating the undesired rhythm consists of two non-overlapping subpopulations: the first one is affected by the stimulation, while the collective activity is registered from the second one. Generally speaking, the second population can be by itself both active and passive; both cases are considered here. The possible applications of suggested technique are discussed. Third, the influence of the external linear feedback on coherence of a noisy or chaotic self-sustained oscillator is considered. Coherence is one of the main properties of self-oscillating systems and plays a key role in the construction of clocks, electronic generators, lasers, etc. The coherence of a noisy limit cycle oscillator in the context of phase dynamics is evaluated by the phase diffusion constant, which is in its turn proportional to the width of the spectral peak of oscillations. Many chaotic oscillators can be described within the framework of phase dynamics, and, therefore, their coherence can be also quantified by the way of the phase diffusion constant. The analytical theory for a general linear feedback, considering noisy systems in the linear and Gaussian approximation is developed and validated by numerical results.}, language = {en} } @article{TyulkinaGoldobinKlimenkoetal.2019, author = {Tyulkina, Irina V. and Goldobin, Denis S. and Klimenko, Lyudmila S. and Pikovskij, Arkadij}, title = {Two-Bunch Solutions for the Dynamics of Ott-Antonsen Phase Ensembles}, series = {Radiophysics and Quantum Electronics}, volume = {61}, journal = {Radiophysics and Quantum Electronics}, number = {8-9}, publisher = {Springer}, address = {New York}, issn = {0033-8443}, doi = {10.1007/s11141-019-09924-7}, pages = {640 -- 649}, year = {2019}, abstract = {We have developed a method for deriving systems of closed equations for the dynamics of order parameters in the ensembles of phase oscillators. The Ott-Antonsen equation for the complex order parameter is a particular case of such equations. The simplest nontrivial extension of the Ott-Antonsen equation corresponds to two-bunch states of the ensemble. Based on the equations obtained, we study the dynamics of multi-bunch chimera states in coupled Kuramoto-Sakaguchi ensembles. We show an increase in the dimensionality of the system dynamics for two-bunch chimeras in the case of identical phase elements and a transition to one-bunch "Abrams chimeras" for imperfect identity (in the latter case, the one-bunch chimeras become attractive).}, language = {en} } @phdthesis{Toenjes2007, author = {T{\"o}njes, Ralf}, title = {Pattern formation through synchronization in systems of nonidentical autonomous oscillators}, url = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus-15973}, school = {Universit{\"a}t Potsdam}, year = {2007}, abstract = {This work is concerned with the spatio-temporal structures that emerge when non-identical, diffusively coupled oscillators synchronize. It contains analytical results and their confirmation through extensive computer simulations. We use the Kuramoto model which reduces general oscillatory systems to phase dynamics. The symmetry of the coupling plays an important role for the formation of patterns. We have studied the ordering influence of an asymmetry (non-isochronicity) in the phase coupling function on the phase profile in synchronization and the intricate interplay between this asymmetry and the frequency heterogeneity in the system. The thesis is divided into three main parts. Chapter 2 and 3 introduce the basic model of Kuramoto and conditions for stable synchronization. In Chapter 4 we characterize the phase profiles in synchronization for various special cases and in an exponential approximation of the phase coupling function, which allows for an analytical treatment. Finally, in the third part (Chapter 5) we study the influence of non-isochronicity on the synchronization frequency in continuous, reaction diffusion systems and discrete networks of oscillators.}, language = {en} } @article{ToenjesKori2022, author = {T{\"o}njes, Ralf and Kori, Hiroshi}, title = {Phase and frequency linear response theory for hyperbolic chaotic oscillators}, series = {Chaos : an interdisciplinary journal of nonlinear science}, volume = {32}, journal = {Chaos : an interdisciplinary journal of nonlinear science}, number = {4}, publisher = {AIP Publishing}, address = {Melville}, issn = {1054-1500}, doi = {10.1063/5.0064519}, pages = {13}, year = {2022}, abstract = {We formulate a linear phase and frequency response theory for hyperbolic flows, which generalizes phase response theory for autonomous limit cycle oscillators to hyperbolic chaotic dynamics. The theory is based on a shadowing conjecture, stating the existence of a perturbed trajectory shadowing every unperturbed trajectory on the system attractor for any small enough perturbation of arbitrary duration and a corresponding unique time isomorphism, which we identify as phase such that phase shifts between the unperturbed trajectory and its perturbed shadow are well defined. The phase sensitivity function is the solution of an adjoint linear equation and can be used to estimate the average change of phase velocity to small time dependent or independent perturbations. These changes in frequency are experimentally accessible, giving a convenient way to define and measure phase response curves for chaotic oscillators. The shadowing trajectory and the phase can be constructed explicitly in the tangent space of an unperturbed trajectory using co-variant Lyapunov vectors. It can also be used to identify the limits of the regime of linear response.}, language = {en} } @article{ToenjesPikovsky2020, author = {T{\"o}njes, Ralf and Pikovsky, Arkady}, title = {Low-dimensional description for ensembles of identical phase oscillators subject to Cauchy noise}, series = {Physical review : E, Statistical, nonlinear and soft matter physics}, volume = {102}, journal = {Physical review : E, Statistical, nonlinear and soft matter physics}, number = {5}, publisher = {American Physical Society}, address = {College Park}, issn = {2470-0045}, doi = {10.1103/PhysRevE.102.052315}, pages = {5}, year = {2020}, abstract = {We study ensembles of globally coupled or forced identical phase oscillators subject to independent white Cauchy noise. We demonstrate that if the oscillators are forced in several harmonics, stationary synchronous regimes can be exactly described with a finite number of complex order parameters. The corresponding distribution of phases is a product of wrapped Cauchy distributions. For sinusoidal forcing, the Ott-Antonsen low-dimensional reduction is recovered.}, language = {en} } @article{ToetzkeKardjilovLenoiretal.2019, author = {T{\"o}tzke, Christian and Kardjilov, Nikolay and Lenoir, Nicolas and Manke, Ingo and Oswald, Sascha and Tengattini, Alessandro}, title = {What comes NeXT?}, series = {Optics express : the international electronic journal of optics}, volume = {27}, journal = {Optics express : the international electronic journal of optics}, number = {20}, publisher = {Optical Society of America}, address = {Washington}, issn = {1094-4087}, doi = {10.1364/OE.27.028640}, pages = {28640 -- 28648}, year = {2019}, abstract = {Here, we report on a new record in the acquisition time for fast neutron tomography. With an optimized imaging setup, it was possible to acquire single radiographic projection images with 10 ms and full tomographies with 155 projections images and a physical spatial resolution of 200 mu m within 1.5 s. This is about 6.7 times faster than the current record. We used the technique to investigate the water infiltration in the soil with a living lupine root system. The fast imaging setup will be part of the future NeXT instrument at ILL in Grenoble with a great field of possible future applications. (C) 2019 Optical Society of America under the terms of the OSA Open Access Publishing Agreement}, language = {en} } @article{UeckerdtFrielerLangeetal.2019, author = {Ueckerdt, Falko and Frieler, Katja and Lange, Stefan and Wenz, Leonie and Luderer, Gunnar and Levermann, Anders}, title = {The economically optimal warming limit of the planet}, series = {Earth system dynamics}, volume = {10}, journal = {Earth system dynamics}, number = {4}, publisher = {Copernicus}, address = {G{\"o}ttingen}, issn = {2190-4979}, doi = {10.5194/esd-10-741-2019}, pages = {741 -- 763}, year = {2019}, abstract = {Both climate-change damages and climate-change mitigation will incur economic costs. While the risk of severe damages increases with the level of global warming (Dell et al., 2014; IPCC, 2014b, 2018; Lenton et al., 2008), mitigating costs increase steeply with more stringent warming limits (IPCC, 2014a; Luderer et al., 2013; Rogelj et al., 2015). Here, we show that the global warming limit that minimizes this century's total economic costs of climate change lies between 1.9 and 2 ∘C, if temperature changes continue to impact national economic growth rates as observed in the past and if instantaneous growth effects are neither compensated nor amplified by additional growth effects in the following years. The result is robust across a wide range of normative assumptions on the valuation of future welfare and inequality aversion. We combine estimates of climate-change impacts on economic growth for 186 countries (applying an empirical damage function from Burke et al., 2015) with mitigation costs derived from a state-of-the-art energy-economy-climate model with a wide range of highly resolved mitigation options (Kriegler et al., 2017; Luderer et al., 2013, 2015). Our purely economic assessment, even though it omits non-market damages, provides support for the international Paris Agreement on climate change. The political goal of limiting global warming to "well below 2 degrees" is thus also an economically optimal goal given above assumptions on adaptation and damage persistence.}, language = {en} } @article{UjevicRashtiGiegetal.2022, author = {Ujevic, Maximiliano and Rashti, Alireza and Gieg, Henrique Leonhard and Tichy, Wolfgang and Dietrich, Tim}, title = {High-accuracy high-mass-ratio simulations for binary neutron stars and their comparison to existing waveform models}, series = {Physical review : D, Particles, fields, gravitation, and cosmology}, volume = {106}, journal = {Physical review : D, Particles, fields, gravitation, and cosmology}, number = {2}, publisher = {American Physical Society}, address = {College Park}, issn = {2470-0010}, doi = {10.1103/PhysRevD.106.023029}, pages = {10}, year = {2022}, abstract = {The subsequent observing runs of the advanced gravitational-wave detector network will likely provide us with various gravitational-wave observations of binary neutron star systems. For an accurate interpretation of these detections, we need reliable gravitational-wave models. To test and to point out how existing models could be improved, we perform a set of high-resolution numerical relativity simulations for four different physical setups with mass ratios q = 1.25, 1.50, 1.75, 2.00, and total gravitational mass M = 2.7 M???. Each configuration is simulated with five different resolutions to allow a proper error assessment. Overall, we find approximately second-order converging results for the dominant (2,2) mode, but also the subdominant (2,1), (3,3), and (4,4) modes, while generally, the convergence order reduces slightly for an increasing mass ratio. Our simulations allow us to validate waveform models, where we find generally good agreement between state-of-the-art models and our data, and to prove that scaling relations for higher modes currently employed for binary black hole waveform modeling also apply for the tidal contribution. Finally, we also test if the current NRTidal model used to describe tidal effects is a valid description for high-mass-ratio systems. We hope that our simulation results can be used to further improve and test waveform models in preparation for the next observing runs.}, language = {en} } @article{UlbrichtMohrAltenburgetal.2021, author = {Ulbricht, Alexander and Mohr, Gunther and Altenburg, Simon J. and Oster, Simon and Maierhofer, Christiane and Bruno, Giovanni}, title = {Can potential defects in LPBF be healed from the laser exposure of subsequent layers?}, series = {Metals : open access journal}, volume = {11}, journal = {Metals : open access journal}, number = {7}, publisher = {MDPI}, address = {Basel}, issn = {2075-4701}, doi = {10.3390/met11071012}, pages = {14}, year = {2021}, abstract = {Additive manufacturing (AM) of metals and in particular laser powder bed fusion (LPBF) enables a degree of freedom in design unparalleled by conventional subtractive methods. To ensure that the designed precision is matched by the produced LPBF parts, a full understanding of the interaction between the laser and the feedstock powder is needed. It has been shown that the laser also melts subjacent layers of material underneath. This effect plays a key role when designing small cavities or overhanging structures, because, in these cases, the material underneath is feed-stock powder. In this study, we quantify the extension of the melt pool during laser illumination of powder layers and the defect spatial distribution in a cylindrical specimen. During the LPBF process, several layers were intentionally not exposed to the laser beam at various locations, while the build process was monitored by thermography and optical tomography. The cylinder was finally scanned by X-ray computed tomography (XCT). To correlate the positions of the unmolten layers in the part, a staircase was manufactured around the cylinder for easier registration. The results show that healing among layers occurs if a scan strategy is applied, where the orientation of the hatches is changed for each subsequent layer. They also show that small pores and surface roughness of solidified material below a thick layer of unmolten material (>200 mu m) serve as seeding points for larger voids. The orientation of the first two layers fully exposed after a thick layer of unmolten powder shapes the orientation of these voids, created by a lack of fusion.}, language = {en} } @article{UllbrichBenduhnJiaetal.2019, author = {Ullbrich, Sascha and Benduhn, Johannes and Jia, Xiangkun and Nikolis, Vasileios C. and Tvingstedt, Kristofer and Piersimoni, Fortunato and Roland, Steffen and Liu, Yuan and Wu, Jinhan and Fischer, Axel and Neher, Dieter and Reineke, Sebastian and Spoltore, Donato and Vandewal, Koen}, title = {Emissive and charge-generating donor-acceptor interfaces for organic optoelectronics with low voltage losses}, series = {Nature materials}, volume = {18}, journal = {Nature materials}, number = {5}, publisher = {Nature Publ. Group}, address = {London}, issn = {1476-1122}, doi = {10.1038/s41563-019-0324-5}, pages = {459 -- 464}, year = {2019}, abstract = {Intermolecular charge-transfer states at the interface between electron donating (D) and accepting (A) materials are crucial for the operation of organic solar cells but can also be exploited for organic light-emitting diodes(1,2). Non-radiative charge-transfer state decay is dominant in state-of-the-art D-A-based organic solar cells and is responsible for large voltage losses and relatively low power-conversion efficiencies as well as electroluminescence external quantum yields in the 0.01-0.0001\% range(3,4). In contrast, the electroluminescence external quantum yield reaches up to 16\% in D-A-based organic light-emitting diodes(5-7). Here, we show that proper control of charge-transfer state properties allows simultaneous occurrence of a high photovoltaic and emission quantum yield within a single, visible-light-emitting D-A system. This leads to ultralow-emission turn-on voltages as well as significantly reduced voltage losses upon solar illumination. These results unify the description of the electro-optical properties of charge-transfer states in organic optoelectronic devices and foster the use of organic D-A blends in energy conversion applications involving visible and ultraviolet photons(8-11).}, language = {en} } @phdthesis{Ullner2004, author = {Ullner, Ekkehard}, title = {Noise-induced phenomena of signal transmission in excitable neural models}, url = {http://nbn-resolving.de/urn:nbn:de:kobv:517-0001522}, school = {Universit{\"a}t Potsdam}, year = {2004}, abstract = {Meine Dissertation behandelt verschiedene neue rauschinduzierte Ph{\"a}nomene in anregbaren Neuronenmodellen, insbesondere solche mit FitzHugh-Nagumo Dynamik. Ich beschreibe das Auftreten von vibronischer Resonanz in anregbaren Systemen. Sowohl in einer anregbaren elektronischen Schaltung als auch im FitzHugh-Nagumo Modell zeige ich, daß eine optimale Amplitude einer hochfrequenten externen Kraft die Signalantwort bez{\"u}glich eines niederfrequenten Signals verbessert. Weiterhin wird der Einfluß von additivem Rauschen auf das Zusammenwirken von stochastischer und vibronischer Resonanz untersucht. Weiterhin untersuche ich Systeme, die sowohl oszillierende als auch anregbare Eigenschaften beinhalten und dadurch zwei interne Frequenzen aufweisen. Ich zeige, daß in solchen Systemen der Effekt der stochastischen Resonanz deutlich erh{\"o}ht werden kann, wenn eine zus{\"a}tzliche hochfrequente Kraft in Resonanz mit den kleinen Oszillationen unterhalb der Anregungsschwelle hinzugenommen wird. Es ist beachtenswert, daß diese Verst{\"a}rkung der stochastischen Resonanz eine geringere Rauschintensit{\"a}t zum Erreichen des Optimums ben{\"o}tigt als die standartm{\"a}ßige stochastische Resonanz in anregbaren Systemen. Ich untersuche Frequenzselektivit{\"a}t bei der rauschinduzierten Signalverarbeitung von Signalen unterhalb der Anregungsschwelle in Systemen mit vielen rauschunterst{\"u}tzten stochastischen Attraktoren. Diese neuen Attraktoren mit abweichenden gemittelten Perioden weisen auch unterschiedliche Phasenbeziehungen zwischen den einzelnen Elementen auf. Ich zeige, daß die Signalantwort des gekoppelten Systems unter verschiedenen Rauscheinwirkungen deutlich verbessert oder auch reduziert werden kann durch das Treiben einzelner Elemente in Resonanz mit diesen neuen Resonanzfrequenzen, die mit passenden Phasenbeziehungen korrespondieren. Weiterhin konnte ich einen rauschinduzierten Phasen{\"u}bergang von einem selbstoszillierenden System zu einem anregbaren System nachweisen. Dieser {\"U}bergang erfolgt durch eine rauschinduzierte Stabilisierung eines deterministisch instabilen Fixpunktes der lokalen Dynamik, w{\"a}hrend die gesamte Phasenraumstruktur des Systems erhalten bleibt. Die gemeinsame Wirkung von Kopplung und Rauschen f{\"u}hrt zu einem neuen Typ von Phasen{\"u}berg{\"a}ngen und bewirkt eine Stabilisierung des Systems. Das sich daraus ergebende rauschinduziert anregbare Regime zeigt charakteristische Eigenschaften von klassisch anregbaren Systemen, wie stochastische Resonanz und Wellenausbreitung. Dieser rauschinduzierte Phasen{\"u}bergang erm{\"o}glicht dadurch die {\"U}bertragung von Signalen durch ansonsten global oszillierende Systeme und die Kontrolle der Signal{\"u}bertragung durch Ver{\"a}nderung der Rauschintensit{\"a}t. Insbesondere er{\"o}ffnen diese theoretischen Ergebnisse einen m{\"o}glichen Mechanismus zur Unterdr{\"u}ckung unerw{\"u}nschter globaler Oszillationen in neuronalen Netzwerken, welche charakteristisch f{\"u}r abnorme medizinische Zust{\"a}nde, wie z.B. bei der Parkinson\′schen Krankheit oder Epilepsie, sind. Die Wirkung von Rauschen w{\"u}rde dann wieder die Anregbarkeit herstellen, die den normalen Zustand der erkrankten Neuronen darstellt.}, language = {en} } @article{UmlandtFeldmannSchnecketal.2020, author = {Umlandt, Maren and Feldmann, David and Schneck, Emanuel and Santer, Svetlana and Bekir, Marek}, title = {Adsorption of photoresponsive surfactants at solid-liquid interfaces}, series = {Langmuir}, volume = {36}, journal = {Langmuir}, number = {46}, publisher = {American Chemical Society}, address = {Washington}, issn = {0743-7463}, doi = {10.1021/acs.langmuir.0c02545}, pages = {14009 -- 14018}, year = {2020}, abstract = {We report on the adsorption kinetics of azoben-zene-containing surfactants on solid surfaces of different hydrophobicity. The understanding of this processes is of great importance for many interfacial phenomena that can be actuated and triggered by light, since the surfactant molecules contain a photoresponsive azobenzene group in their hydrophobic tail. Three surfactant types are studied, differing in the spacer connecting the headgroup and the azobenzene unit by between 6 and 10 CH2 groups. Under irradiation with light of a suitable wavelength, the azobenzene undergoes reversible photoisomerization between two states, a nonpolar trans-state and a highly polar cis-state. Consequently, the surfactant molecule changes its hydrophobicity and thus affinity to a surface depending on the photoisomerization state of the azobenzene. The adsorption behavior on hydrophilic (glass) and hydrophobic (TeflonAF) surfaces is analyzed using quartz crystal microbalance with dissipation (QCM-D) and zeta-potential measurements. At equilibrium, the adsorbed surfactant amount is almost twice as large on glass compared to TeflonAF for both isomers. The adsorption rate for the trans-isomers on both surfaces is similar, but the desorption rate of the trans-isomers is faster at the glass-water interface than at the Teflon-water interface. This result demonstrates that the trans-isomers have higher affinity for the glass surface, so the trans-to-cis ratios on glass and TeflonAF are 80/1 and 2/1, respectively, with similar trends for all three surfactant types.}, language = {en} } @article{UolaLeverGuehneetal.2018, author = {Uola, Roope and Lever, Fabiano and G{\"u}hne, Otfried and Pellonpaa, Juha-Pekka}, title = {Unified picture for spatial, temporal, and channel steering}, series = {Physical review : A, Atomic, molecular, and optical physics}, volume = {97}, journal = {Physical review : A, Atomic, molecular, and optical physics}, number = {3}, publisher = {American Physical Society}, address = {College Park}, issn = {2469-9926}, doi = {10.1103/PhysRevA.97.032301}, pages = {6}, year = {2018}, abstract = {Quantum steering describes how local actions on a quantum system can affect another, spacelike separated, quantum state. Lately, quantum steering has been formulated also for timelike scenarios and for quantum channels. We approach all the three scenarios as one using tools from Stinespring dilations of quantum channels. By applying our technique we link all three steering problems one-to-one with the incompatibility of quantum measurements, a result formerly known only for spatial steering. We exploit this connection by showing how measurement uncertainty relations can be used as tight steering inequalities for all three scenarios. Moreover, we show that certain notions of temporal and spatial steering are fully equivalent and prove a hierarchy between temporal steering and macrorealistic hidden variable models.}, language = {en} } @misc{UtechtKlamroth2018, author = {Utecht, Manuel Martin and Klamroth, Tillmann}, title = {Local resonances in STM manipulation of chlorobenzene on Si(111)-7×7}, series = {Molecular Physics}, journal = {Molecular Physics}, url = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-412970}, pages = {11}, year = {2018}, abstract = {Hot localised charge carriers on the Si(111)-7×7 surface are modelled by small charged clusters. Such resonances induce non-local desorption, i.e. more than 10 nm away from the injection site, of chlorobenzene in scanning tunnelling microscope experiments. We used such a cluster model to characterise resonance localisation and vibrational activation for positive and negative resonances recently. In this work, we investigate to which extent the model depends on details of the used cluster or quantum chemistry methods and try to identify the smallest possible cluster suitable for a description of the neutral surface and the ion resonances. Furthermore, a detailed analysis for different chemisorption orientations is performed. While some properties, as estimates of the resonance energy or absolute values for atomic changes, show such a dependency, the main findings are very robust with respect to changes in the model and/or the chemisorption geometry.}, language = {en} } @phdthesis{Uyaver2004, author = {Uyaver, Sahin}, title = {Simulation of annealed polyelectrolytes in poor solvents}, url = {http://nbn-resolving.de/urn:nbn:de:kobv:517-0001488}, school = {Universit{\"a}t Potsdam}, year = {2004}, abstract = {Polymere sind lange kettenartige Molek{\"u}le. Sie bestehen aus vielen elementaren chemischen Einheiten, den Monomeren, die durch kovalente Bindungen aneinander gekettet sind. Polyelektrolyte sind Polymere, die ionisierbare Monomeren enthalten. Aufgrund ihrer speziellen Eigenschaften sind Polyelektrolyte sowohl in der Molekular- und Zellbiologie von großen Bedeutung als auch in der Chemie großtechnisch relevant. Verglichen mit ungeladenen Polymeren sind Polyelektrolyte theoretisch noch wenig verstanden. Insbesondere gilt dies f{\"u}r Polyelektrolyte in sogenanntem schlechten L{\"o}sungsmittel. Ein schlechtes L{\"o}sungsmittel bewirkt eine effektive Anziehung zwischen den Monomeren. F{\"u}r Polyelektrolyte in schlechtem L{\"o}sungsmittel kommt es daher zu einer Konkurrenz zwischen dieser Anziehung und der elektrostatischen Abstoßung. Geladene Polymere werden im Rahmen der chemischen Klassifikation in starke und schwache Polyelektrolyte unterschieden. Erstere zeigen vollst{\"a}ndige Dissoziation unabh{\"a}ngig vom pH-Wert der L{\"o}sung. Die Position der Ladungen auf der Kette wird ausschließlich w{\"a}hrend der Polymersynthese festgelegt. In der Physik spricht man deshalb von Polyelektrolyten mit eingefrorener Ladungsverteilung (quenched polyelectrolytes). Im Falle von schwachen Polyelektrolyten ist die Ladungsdichte auf der Kette nicht konstant, sondern wird durch der pH-Wert der L{\"o}sung kontrolliert. Durch Rekombinations- und Dissoziationsprozesse sind die Ladungen auf der Kette beweglich. Im allgemeinen stellt sich eine inhomogene Gleichgewichtsverteilung ein, die mit der Struktur der Kette gekoppelt ist. Diese Polymere werden deshalb auch Polyelektrolyte mit Gleichgewichtsladungsverteilung (annealed polyelectrolytes) genannt. Wegen des zus{\"a}tzlichen Freiheitsgrades in der Ladungsverteilung werden eine Reihe ungew{\"o}hnlicher Eigenschaften theoretisch vorhergesagt. Mit Hilfe von Simulationen ist es zum ersten Mal gelungen, zu zeigen daß 'annealed' Polyelektrolyte in relativ schlechtem L{\"o}sungsmittel einen diskontinuierlichen Phasen{\"u}bergang durchlaufen, wenn ein kritischer pH-Werts der L{\"o}sung {\"u}berschritten wird. Bei diesem Phasen{\"u}bergang, gehen die Polyelektolyte von einer schwach geladenen kompakten globul{\"a}ren Struktur zu einer stark geladenen gestreckten Konfiguration {\"u}ber. Aufgrund theoretischer Vorhersagen wird erwartet, daß die globul{\"a}re Struktur in weniger schlechtem L{\"o}sungsmittel instabil wird und sich eine Perlenkettenkonfiguration ausbildet. Diese Vorhersage konnte f{\"u}r 'annealed' Polyelektrolyte mit den durchgef{\"u}hrten Simulationen zum ersten Mal best{\"a}tigt werden - inzwischen auch durch erste experimentelle Ergebnisse. Schließlich zeigen die Simulationen auch, daß annealed Polyelektrolyte bei einer kritischen Salzkonzentration in der L{\"o}sung einen scharfen {\"U}bergang zwischen einem stark geladenen gestreckten Zustand und einem schwach geladenen globul{\"a}ren Zustand aufweisen, wiederum in {\"U}bereinstimmung mit theoretischen Erwartungen.}, language = {en} } @article{VafinLazarFichtneretal.2018, author = {Vafin, Sergei and Lazar, M. and Fichtner, H. and Schlickeiser, R. and Drillisch, M.}, title = {Solar wind temperature anisotropy constraints from streaming instabilities}, series = {Astronomy and astrophysics : an international weekly journal}, volume = {613}, journal = {Astronomy and astrophysics : an international weekly journal}, publisher = {EDP Sciences}, address = {Les Ulis}, issn = {1432-0746}, doi = {10.1051/0004-6361/201731852}, pages = {5}, year = {2018}, abstract = {Due to the relatively low rate of particle-particle collisions in the solar wind, kinetic instabilities (e.g., the mirror and firehose) play an important role in regulating large deviations from temperature isotropy. These instabilities operate in the high beta(parallel to) > 1 plasmas, and cannot explain the other limits of the temperature anisotropy reported by observations in the low beta beta(parallel to) < 1 regimes. However, the instability conditions are drastically modified in the presence of streaming (or counterstreaming) components, which are ubiquitous in space plasmas. These effects have been analyzed for the solar wind conditions in a large interval of heliospheric distances, 0.3-2.5 AU. It was found that proton counter-streams are much more crucial for plasma stability than electron ones. Moreover, new instability thresholds can potentially explain all observed bounds on the temperature anisotropy, and also the level of differential streaming in the solar wind.}, language = {en} } @article{VafinRafighiPohletal.2018, author = {Vafin, Sergei and Rafighi, Iman and Pohl, Martin and Niemiec, Jacek}, title = {The Electrostatic Instability for Realistic Pair Distributions in Blazar/EBL Cascades}, series = {The astrophysical journal : an international review of spectroscopy and astronomical physics}, volume = {857}, journal = {The astrophysical journal : an international review of spectroscopy and astronomical physics}, number = {1}, publisher = {IOP Publ. Ltd.}, address = {Bristol}, issn = {0004-637X}, doi = {10.3847/1538-4357/aab552}, pages = {12}, year = {2018}, abstract = {This work revisits the electrostatic instability for blazar-induced pair beams propagating through the intergalactic medium (IGM) using linear analysis and PIC simulations. We study the impact of the realistic distribution function of pairs resulting from the interaction of high-energy gamma-rays with the extragalactic background light. We present analytical and numerical calculations of the linear growth rate of the instability for the arbitrary orientation of wave vectors. Our results explicitly demonstrate that the finite angular spread of the beam dramatically affects the growth rate of the waves, leading to the fastest growth for wave vectors quasi-parallel to the beam direction and a growth rate at oblique directions that is only a factor of 2-4 smaller compared to the maximum. To study the nonlinear beam relaxation, we performed PIC simulations that take into account a realistic wide-energy distribution of beam particles. The parameters of the simulated beam-plasma system provide an adequate physical picture that can be extrapolated to realistic blazar-induced pairs. In our simulations, the beam looses only 1\% of its energy, and we analytically estimate that the beam would lose its total energy over about 100 simulation times. An analytical scaling is then used to extrapolate the parameters of realistic blazar-induced pair beams. We find that they can dissipate their energy slightly faster by the electrostatic instability than through inverse-Compton scattering. The uncertainties arising from, e.g., details of the primary gamma-ray spectrum are too large to make firm statements for individual blazars, and an analysis based on their specific properties is required.}, language = {en} } @article{VafinRiazantsevaPohl2019, author = {Vafin, Sergei and Riazantseva, Maria and Pohl, Martin}, title = {Coulomb collisions as a candidate for temperature anisotropy constraints in the solar wind}, series = {The astrophysical journal : an international review of spectroscopy and astronomical physics ; Part 2, Letters}, volume = {871}, journal = {The astrophysical journal : an international review of spectroscopy and astronomical physics ; Part 2, Letters}, number = {1}, publisher = {IOP Publ. Ltd.}, address = {Bristol}, issn = {2041-8205}, doi = {10.3847/2041-8213/aafb11}, pages = {6}, year = {2019}, abstract = {Many solar wind observations at 1 au indicate that the proton (as well as electron) temperature anisotropy is limited. The data distribution in the (A(a), beta(a),(parallel to))-plane have a rhombic-shaped form around beta(a),(parallel to) similar to 1. The boundaries of the temperature anisotropy at beta(a),(parallel to) > 1 can be well explained by the threshold conditions of the mirror (whistler) and oblique proton (electron) firehose instabilities in a bi-Maxwellian plasma, whereas the physical mechanism of the similar restriction at beta(a),(parallel to) < 1 is still under debate. One possible option is Coulomb collisions, which we revisit in the current work. We derive the relaxation rate nu(A)(aa) of the temperature anisotropy in a bi-Maxwellian plasma that we then study analytically and by observed proton data from WIND. We found that nu(A)(pp) increases toward small beta(p),(parallel to) < 1. We matched the data distribution in the (A(p), beta(p),(parallel to))-plane with the constant contour nu(A)(pp) = 2.8 . 10(-6) s(-1), corresponding to the minimum value for collisions to play a role. This contour fits rather well the left boundary of the rhombic-shaped data distribution in the (A(p), beta(p),(parallel to))-plane. Thus, Coulomb collisions are an interesting candidate for explaining the limitations of the temperature anisotropy in the solar wind with small beta(a),(parallel to) < 1 at 1 au.}, language = {en} } @phdthesis{ValenciaSanmiguel2003, author = {Valencia Sanmiguel, Antonio}, title = {Condensation and crystallization on patterned surfaces}, doi = {10.25932/publishup-65195}, url = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-651950}, school = {Universit{\"a}t Potsdam}, pages = {102, XXII}, year = {2003}, abstract = {Condensation and crystallization are omnipresent phenomena in nature. The formation of droplets or crystals on a solid surface are familiar processes which, beyond their scientific interest, are required in many technological applications. In recent years, experimental techniques have been developed which allow patterning a substrate with surface domains of molecular thickness, surface area in the mesoscopic scale, and different wettabilities (i.e., different degrees of preference for a substance that is in contact with the substrate). The existence of new patterned surfaces has led to increased theoretical efforts to understand wetting phenomena in such systems. In this thesis, we deal with some problems related to the equilibrium of phases (e.g., liquid-vapor coexistence) and the kinetics of phase separation in the presence of chemically patterned surfaces. Two different cases are considered: (i) patterned surfaces in contact with liquid and vapor, and (ii) patterned surfaces in contact with a crystalline phase. One of the problems that we have studied is the following: It is widely believed that if air containing water vapor is cooled to its dew point, droplets of water are immediately formed. Although common experience seems to support this view, it is not correct. It is only when air is cooled well below its dew point that the phase transition occurs immediately. A vapor cooled slightly below its dew point is in a metastable state, meaning that the liquid phase is more stable than the vapor, but the formation of droplets requires some time to occur, which can be very long. It was first pointed out by J. W. Gibbs that the metastability of a vapor depends on the energy necessary to form a nucleus (a droplet of a critical size). Droplets smaller than the critical size will tend to disappear, while droplets larger than the critical size will tend to grow. This is consistent with an energy barrier that has its maximum at the critical size, as is the case for droplets formed directly in the vapor or in contact with a chemically uniform planar wall. Classical nucleation theory describes the time evolution of the condensation in terms of the random process of droplet growth through this energy barrier. This process is activated by thermal fluctuations, which eventually will form a droplet of the critical size. We consider nucleation of droplets from a vapor on a substrate patterned with easily wettable (lyophilic) circular domains. Under certain conditions of pressure and temperature, the condensation of a droplet on a lyophilic circular domain proceeds through a barrier with two maxima (a double barrier). We have extended classical nucleation theory to account for the kinetics of nucleation through a double barrier, and applied this extension to nucleation on lyophilic circular domains.}, language = {en} } @article{VandewalBenduhnSchellhammeretal.2017, author = {Vandewal, Koen and Benduhn, Johannes and Schellhammer, Karl Sebastian and Vangerven, Tim and R{\"u}ckert, Janna E. and Piersimoni, Fortunato and Scholz, Reinhard and Zeika, Olaf and Fan, Yeli and Barlow, Stephen and Neher, Dieter and Marder, Seth R. and Manca, Jean and Spoltore, Donato and Cuniberti, Gianaurelio and Ortmann, Frank}, title = {Absorption Tails of Donor}, series = {Journal of the American Chemical Society}, volume = {139}, journal = {Journal of the American Chemical Society}, number = {4}, publisher = {American Chemical Society}, address = {Washington}, issn = {0002-7863}, doi = {10.1021/jacs.6b12857}, pages = {1699 -- 1704}, year = {2017}, abstract = {In disordered organic semiconductors, the transfer of a rather localized charge carrier from one site to another triggers a deformation of the molecular structure quantified by the intramolecular relaxation energy. A similar structural relaxation occurs upon population of intermolecular charge-transfer (CT) states formed at organic electron donor (D)-acceptor (A) interfaces. Weak CT absorption bands for D A complexes occur at photon energies below the optical gaps of both the donors and the C-60 acceptor as a result of optical transitions from the neutral ground state to the ionic CT state. In this work, we show that temperature-activated intramolecular vibrations of the ground state play a major role in determining the line shape of such CT absorption bands. This allows us to extract values for the relaxation energy related to the geometry change from neutral to ionic CT complexes. Experimental values for the relaxation energies of 20 D:C-60 CT complexes correlate with values calculated within density functional theory. These results provide an experimental method for determining the polaron relaxation energy in solid-state organic D-A blends and show the importance of a reduced relaxation energy, which we introduce to characterize thermally activated CT processes.}, language = {en} } @article{VargheseChechkinMetzleretal.2021, author = {Varghese, Alan J. and Chechkin, Aleksei and Metzler, Ralf and Sujith, Raman I.}, title = {Capturing multifractality of pressure fluctuations in thermoacoustic systems using fractional-order derivatives}, series = {Chaos : an interdisciplinary journal of nonlinear science}, volume = {31}, journal = {Chaos : an interdisciplinary journal of nonlinear science}, number = {3}, publisher = {American Institute of Physics, AIP}, address = {Melville}, issn = {1054-1500}, doi = {10.1063/5.0032585}, pages = {9}, year = {2021}, abstract = {The stable operation of a turbulent combustor is not completely silent; instead, there is a background of small amplitude aperiodic acoustic fluctuations known as combustion noise. Pressure fluctuations during this state of combustion noise are multifractal due to the presence of multiple temporal scales that contribute to its dynamics. However, existing models are unable to capture the multifractality in the pressure fluctuations. We conjecture an underlying fractional dynamics for the thermoacoustic system and obtain a fractional-order model for pressure fluctuations. The data from this model has remarkable visual similarity to the experimental data and also has a wide multifractal spectrum during the state of combustion noise. Quantitative similarity with the experimental data in terms of the Hurst exponent and the multifractal spectrum is observed during the state of combustion noise. This model is also able to produce pressure fluctuations that are qualitatively similar to the experimental data acquired during intermittency and thermoacoustic instability. Furthermore, we argue that the fractional dynamics vanish as we approach the state of thermoacoustic instability.}, language = {en} } @phdthesis{Varykhalov2005, author = {Varykhalov, Andrei}, title = {Quantum-size effects in the electronic structure of novel self-organized systems with reduced dimensionality}, url = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus-5784}, school = {Universit{\"a}t Potsdam}, year = {2005}, abstract = {The Thesis is focused on the properties of self-organized nanostructures. Atomic and electronic properties of different systems have been investigated using methods of electron diffraction, scanning tunneling microscopy and photoelectron spectroscopy. Implementation of the STM technique (including design, construction, and tuning of the UHV experimental set-up) has been done in the framework of present work. This time-consuming work is reported to greater detail in the experimental part of this Thesis. The scientific part starts from the study of quantum-size effects in the electronic structure of a two-dimensional Ag film on the supporting substrate Ni(111). Distinct quantum well states in the sp-band of Ag were observed in photoelectron spectra. Analysis of thickness- and angle-dependent photoemission supplies novel information on the properties of the interface. For the first time the Ni(111) relative band gap was indirectly probed in the ground-state through the electronic structure of quantum well states in the adlayer. This is particularly important for Ni where valence electrons are strongly correlated. Comparison of the experiment with calculations performed in the formalism of the extended phase accumulation model gives the substrate gap which is fully consistent with the one obtained by ab-initio LDA calculations. It is, however, in controversy to the band structure of Ni measured directly by photoemission. These results lend credit to the simplest view of photoemission from Ni, assigning early observed contradictions between theory and experiments to electron correlation effects in the final state of photoemission. Further, nanosystems of lower dimensionality have been studied. Stepped surfaces W(331) and W(551) were used as one-dimensional model systems and as templates for self-organization of Au nanoclusters. Photon energy dependent photoemission revealed a surface resonance which was never observed before on W(110) which is the base plane of the terrace microsurfaces. The dispersion E(k) of this state measured on stepped W(331) and W(551) with angle-resolved photoelectron spectroscopy is modified by a strong umklapp effect. It appears as two parabolas shifted symmetrically relative to the microsurface normal by half of the Brillouin zone of the step superlattice. The reported results are very important for understanding of the electronic properties of low-dimensional nanostructures. It was also established that W(331) and W(551) can serve as templates for self-organization of metallic nanostructures. A combined study of electronic and atomic properties of sub-monolayer amounts of gold deposited on these templates have shown that if the substrate is slightly pre-oxidized and the temperature is elevated, then Au can alloy with the first monolayer of W. As a result, a nanostructure of uniform clusters of a surface alloy is produced all over the steps. Such clusters feature a novel sp-band in the vicinity of the Fermi level, which appears split into constant energy levels due to effects of lateral quantization. The last and main part of this work is devoted to large-scale reconstructions on surfaces and nanostructures self-assembled on top. The two-dimensional surface carbide W(110)/C-R(15x3) has been extensively investigated. Photoemission studies of quantum size effects in the electronic structure of this reconstruction, combined with an investigation of its surface geometry, lead to an advanced structural model of the carbide overlayer. It was discovered that W(110)/C-R(15x3) can control self-organization of adlayers into nanostructures with extremely different electronic and structural properties. Thus, it was established that at elevated temperature the R(15x3) superstructure controls the self-assembly of sub-monolayer amounts of Au into nm-wide nanostripes. Based on the results of core level photoemission, the R(15x3)-induced surface alloying which takes place between Au and W can be claimed as driving force of self-organization. The observed stripes exhibit a characteristic one-dimensional electronic structure with laterally quantized d-bands. Obviously, these are very important for applications, since dimensions of electronic devices have already stepped into the nm-range, where quantum-size phenomena must undoubtedly be considered. Moreover, formation of perfectly uniform molecular clusters of C60 was demonstrated and described in terms of the van der Waals formalism. It is the first experimental observation of two-dimensional fullerene nanoclusters with "magic numbers". Calculations of the cluster potentials using the static approach have revealed characteristic minima in the interaction energy. They are achieved for 4 and 7 molecules per cluster. The obtained "magic numbers" and the corresponding cluster structures are fully consistent with the results of the STM measurements.}, subject = {Nanostruktur}, language = {en} } @misc{VarykhalovFreyseAguileraetal.2020, author = {Varykhalov, Andrei and Freyse, Friedrich and Aguilera, Irene and Battiato, Marco and Krivenkov, Maxim and Marchenko, Dmitry and Bihlmayer, Gustav and Blugel, Stefan and Rader, Oliver and Sanchez-Barriga, Jaime}, title = {Effective mass enhancement and ultrafast electron dynamics of Au(111) surface state coupled to a quantum well}, series = {Zweitver{\"o}ffentlichungen der Universit{\"a}t Potsdam : Mathematisch-Naturwissenschaftliche Reihe}, journal = {Zweitver{\"o}ffentlichungen der Universit{\"a}t Potsdam : Mathematisch-Naturwissenschaftliche Reihe}, number = {1}, issn = {1866-8372}, doi = {10.25932/publishup-54989}, url = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-549892}, pages = {11}, year = {2020}, abstract = {We show that, although the equilibrium band dispersion of the Shockley-type surface state of two-dimensional Au(111) quantum films grown on W(110) does not deviate from the expected free-electron-like behavior, its nonequilibrium energy-momentum dispersion probed by time- and angle-resolved photoemission exhibits a remarkable kink above the Fermi level due to a significant enhancement of the effective mass. The kink is pronounced for certain thicknesses of the Au quantum well and vanishes in the very thin limit. We identify the kink as induced by the coupling between the Au(111) surface state and emergent quantum-well states which probe directly the buried gold-tungsten interface. The signatures of the coupling are further revealed by our time-resolved measurements which show that surface state and quantum-well states thermalize together behaving as dynamically locked electron populations. In particular, relaxation of hot carriers following laser excitation is similar for both surface state and quantum-well states and much slower than expected for a bulk metallic system. The influence of quantum confinement on the interplay between elementary scattering processes of the electrons at the surface and ultrafast carrier transport in the direction perpendicular to the surface is shown to be the reason for the slow electron dynamics.}, language = {en} } @article{VarykhalovFreyseAguileraetal.2020, author = {Varykhalov, Andrei and Freyse, Friedrich and Aguilera, Irene and Battiato, Marco and Krivenkov, Maxim and Marchenko, Dmitry and Bihlmayer, Gustav and Blugel, Stefan and Rader, Oliver and Sanchez-Barriga, Jaime}, title = {Effective mass enhancement and ultrafast electron dynamics of Au(111) surface state coupled to a quantum well}, series = {Physical Review Research}, volume = {2}, journal = {Physical Review Research}, number = {1}, publisher = {American Physical Society}, address = {Ridge, NY}, issn = {0031-9007}, doi = {10.1103/PhysRevResearch.2.013343}, pages = {1 -- 9}, year = {2020}, abstract = {We show that, although the equilibrium band dispersion of the Shockley-type surface state of two-dimensional Au(111) quantum films grown on W(110) does not deviate from the expected free-electron-like behavior, its nonequilibrium energy-momentum dispersion probed by time- and angle-resolved photoemission exhibits a remarkable kink above the Fermi level due to a significant enhancement of the effective mass. The kink is pronounced for certain thicknesses of the Au quantum well and vanishes in the very thin limit. We identify the kink as induced by the coupling between the Au(111) surface state and emergent quantum-well states which probe directly the buried gold-tungsten interface. The signatures of the coupling are further revealed by our time-resolved measurements which show that surface state and quantum-well states thermalize together behaving as dynamically locked electron populations. In particular, relaxation of hot carriers following laser excitation is similar for both surface state and quantum-well states and much slower than expected for a bulk metallic system. The influence of quantum confinement on the interplay between elementary scattering processes of the electrons at the surface and ultrafast carrier transport in the direction perpendicular to the surface is shown to be the reason for the slow electron dynamics.}, language = {en} } @article{VazdaCruzBuechnerFondelletal.2022, author = {Vaz da Cruz, Vinicius and B{\"u}chner, Robby and Fondell, Mattis and Pietzsch, Annette and Eckert, Sebastian and F{\"o}hlisch, Alexander}, title = {Targeting individual tautomers in equilibrium by resonant inelastic X-ray scattering}, series = {The journal of physical chemistry letters}, volume = {13}, journal = {The journal of physical chemistry letters}, number = {10}, publisher = {American Chemical Society}, address = {Washington}, issn = {1948-7185}, doi = {10.1021/acs.jpclett.1c03453}, pages = {2459 -- 2466}, year = {2022}, abstract = {Tautomerism is one of the most important forms of isomerism, owing to the facile interconversion between species and the large differences in chemical properties introduced by the proton transfer connecting the tautomers. Spectroscopic techniques are often used for the characterization of tautomers. In this context, separating the overlapping spectral response of coexisting tautomers is a long-standing challenge in chemistry. Here, we demonstrate that by using resonant inelastic X-ray scattering tuned to the core excited states at the site of proton exchange between tautomers one is able to experimentally disentangle the manifold of valence excited states of each tautomer in a mixture. The technique is applied to the prototypical keto-enol equilibrium of 3-hydroxypyridine in aqueous solution. We detect transitions from the occupied orbitals into the LUMO for each tautomer in solution, which report on intrinsic and hydrogen-bond-induced orbital polarization within the pi and sigma manifolds at the proton-transfer site.}, language = {en} } @article{VazdaCruzEckertIannuzzietal.2019, author = {Vaz da Cruz, Vinicius and Eckert, Sebastian and Iannuzzi, Marcella and Ertan, Emelie and Pietzsch, Annette and Couto, Rafael C. and Niskanen, Johannes and Fondell, Mattis and Dantz, Marcus and Schmitt, Thorsten and Lu, Xingye and McNally, Daniel and Jay, Raphael Martin and Kimberg, Victor and F{\"o}hlisch, Alexander and Odelius, Michael}, title = {Probing hydrogen bond strength in liquid water by resonant inelastic X-ray scattering}, series = {Nature Communications}, volume = {10}, journal = {Nature Communications}, publisher = {Nature Publ. Group}, address = {London}, issn = {2041-1723}, doi = {10.1038/s41467-019-08979-4}, pages = {9}, year = {2019}, abstract = {Local probes of the electronic ground state are essential for understanding hydrogen bonding in aqueous environments. When tuned to the dissociative core-excited state at the O1s pre-edge of water, resonant inelastic X-ray scattering back to the electronic ground state exhibits a long vibrational progression due to ultrafast nuclear dynamics. We show how the coherent evolution of the OH bonds around the core-excited oxygen provides access to high vibrational levels in liquid water. The OH bonds stretch into the long-range part of the potential energy curve, which makes the X-ray probe more sensitive than infra-red spectroscopy to the local environment. We exploit this property to effectively probe hydrogen bond strength via the distribution of intramolecular OH potentials derived from measurements. In contrast, the dynamical splitting in the spectral feature of the lowest valence-excited state arises from the short-range part of the OH potential curve and is rather insensitive to hydrogen bonding.}, language = {en} } @article{VazdaCruzIgnatovaCoutoetal.2019, author = {Vaz da Cruz, Vin{\´i}cius and Ignatova, Nina and Couto, Rafael and Fedotov, Daniil and Rehn, Dirk R. and Savchenko, Viktoriia and Norman, Patrick and {\AA}gren, Hans and Polyutov, Sergey and Niskanen, Johannes and Eckert, Sebastian and Jay, Raphael Martin and Fondell, Mattis and Schmitt, Thorsten and Pietzsch, Annette and F{\"o}hlisch, Alexander and Odelius, Michael and Kimberg, Victor and Gel'mukhanov, Faris}, title = {Nuclear dynamics in resonant inelastic X-ray scattering and X-ray absorption of methanol}, series = {The journal of chemical physics : bridges a gap between journals of physics and journals of chemistr}, volume = {150}, journal = {The journal of chemical physics : bridges a gap between journals of physics and journals of chemistr}, number = {23}, publisher = {American Institute of Physics}, address = {Melville}, issn = {0021-9606}, doi = {10.1063/1.5092174}, pages = {20}, year = {2019}, abstract = {We report on a combined theoretical and experimental study of core-excitation spectra of gas and liquid phase methanol as obtained with the use of X-ray absorption spectroscopy (XAS) and resonant inelastic X-ray scattering (RIXS). The electronic transitions are studied with computational methods that include strict and extended second-order algebraic diagrammatic construction [ADC(2) and ADC(2)-x], restricted active space second-order perturbation theory, and time-dependent density functional theory-providing a complete assignment of the near oxygen K-edge XAS. We show that multimode nuclear dynamics is of crucial importance for explaining the available experimental XAS and RIXS spectra. The multimode nuclear motion was considered in a recently developed "mixed representation" where dissociative states and highly excited vibrational modes are accurately treated with a time-dependent wave packet technique, while the remaining active vibrational modes are described using Franck-Condon amplitudes. Particular attention is paid to the polarization dependence of RIXS and the effects of the isotopic substitution on the RIXS profile in the case of dissociative core-excited states. Our approach predicts the splitting of the 2a RIXS peak to be due to an interplay between molecular and pseudo-atomic features arising in the course of transitions between dissociative core- and valence-excited states. The dynamical nature of the splitting of the 2a peak in RIXS of liquid methanol near pre-edge core excitation is shown. The theoretical results are in good agreement with our liquid phase measurements and gas phase experimental data available from the literature. (C) 2019 Author(s).}, language = {en} } @phdthesis{Velk2022, author = {Velk, Natalia}, title = {Investigation of the interaction of lysozyme with poly(l-lysine)/hyaluronic acid multilayers}, school = {Universit{\"a}t Potsdam}, pages = {85}, year = {2022}, language = {en} } @misc{VilkAghionAvgaretal.2022, author = {Vilk, Ohad and Aghion, Erez and Avgar, Tal and Beta, Carsten and Nagel, Oliver and Sabri, Adal and Sarfati, Raphael and Schwartz, Daniel K. and Weiß, Matthias and Krapf, Diego and Nathan, Ran and Metzler, Ralf and Assaf, Michael}, title = {Unravelling the origins of anomalous diffusion}, series = {Zweitver{\"o}ffentlichungen der Universit{\"a}t Potsdam : Mathematisch-Naturwissenschaftliche Reihe}, journal = {Zweitver{\"o}ffentlichungen der Universit{\"a}t Potsdam : Mathematisch-Naturwissenschaftliche Reihe}, number = {1303}, issn = {1866-8372}, doi = {10.25932/publishup-57764}, url = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-577643}, pages = {16}, year = {2022}, abstract = {Anomalous diffusion or, more generally, anomalous transport, with nonlinear dependence of the mean-squared displacement on the measurement time, is ubiquitous in nature. It has been observed in processes ranging from microscopic movement of molecules to macroscopic, large-scale paths of migrating birds. Using data from multiple empirical systems, spanning 12 orders of magnitude in length and 8 orders of magnitude in time, we employ a method to detect the individual underlying origins of anomalous diffusion and transport in the data. This method decomposes anomalous transport into three primary effects: long-range correlations ("Joseph effect"), fat-tailed probability density of increments ("Noah effect"), and nonstationarity ("Moses effect"). We show that such a decomposition of real-life data allows us to infer nontrivial behavioral predictions and to resolve open questions in the fields of single-particle tracking in living cells and movement ecology.}, language = {en} } @article{VilkAghionAvgaretal.2022, author = {Vilk, Ohad and Aghion, Erez and Avgar, Tal and Beta, Carsten and Nagel, Oliver and Sabri, Adal and Sarfati, Raphael and Schwartz, Daniel K. and Weiß, Matthias and Krapf, Diego and Nathan, Ran and Metzler, Ralf and Assaf, Michael}, title = {Unravelling the origins of anomalous diffusion}, series = {Physical review research / American Physical Society}, volume = {4}, journal = {Physical review research / American Physical Society}, number = {3}, publisher = {American Physical Society}, address = {College Park, MD}, issn = {2643-1564}, doi = {10.1103/PhysRevResearch.4.033055}, pages = {16}, year = {2022}, abstract = {Anomalous diffusion or, more generally, anomalous transport, with nonlinear dependence of the mean-squared displacement on the measurement time, is ubiquitous in nature. It has been observed in processes ranging from microscopic movement of molecules to macroscopic, large-scale paths of migrating birds. Using data from multiple empirical systems, spanning 12 orders of magnitude in length and 8 orders of magnitude in time, we employ a method to detect the individual underlying origins of anomalous diffusion and transport in the data. This method decomposes anomalous transport into three primary effects: long-range correlations ("Joseph effect"), fat-tailed probability density of increments ("Noah effect"), and nonstationarity ("Moses effect"). We show that such a decomposition of real-life data allows us to infer nontrivial behavioral predictions and to resolve open questions in the fields of single-particle tracking in living cells and movement ecology.}, language = {en} } @article{VilkAghionNathanetal.2022, author = {Vilk, Ohad and Aghion, Erez and Nathan, Ran and Toledo, Sivan and Metzler, Ralf and Assaf, Michael}, title = {Classification of anomalous diffusion in animal movement data using power spectral analysis}, series = {Journal of physics : A, Mathematical and theoretical}, volume = {55}, journal = {Journal of physics : A, Mathematical and theoretical}, number = {33}, publisher = {IOP Publishing}, address = {Bristol}, issn = {1751-8113}, doi = {10.1088/1751-8121/ac7e8f}, pages = {16}, year = {2022}, abstract = {The field of movement ecology has seen a rapid increase in high-resolution data in recent years, leading to the development of numerous statistical and numerical methods to analyse relocation trajectories. Data are often collected at the level of the individual and for long periods that may encompass a range of behaviours. Here, we use the power spectral density (PSD) to characterise the random movement patterns of a black-winged kite (Elanus caeruleus) and a white stork (Ciconia ciconia). The tracks are first segmented and clustered into different behaviours (movement modes), and for each mode we measure the PSD and the ageing properties of the process. For the foraging kite we find 1/f noise, previously reported in ecological systems mainly in the context of population dynamics, but not for movement data. We further suggest plausible models for each of the behavioural modes by comparing both the measured PSD exponents and the distribution of the single-trajectory PSD to known theoretical results and simulations.}, language = {en} } @article{VilkCamposMendezetal.2022, author = {Vilk, Ohad and Campos, Daniel and M{\´e}ndez, Vicen{\c{c}} and Lourie, Emmanuel and Nathan, Ran and Assaf, Michael}, title = {Phase transition in a non-Markovian animal exploration model with preferential returns}, series = {Physical review letters}, volume = {128}, journal = {Physical review letters}, number = {14}, publisher = {American Physical Society}, address = {College Park}, issn = {0031-9007}, doi = {10.1103/PhysRevLett.128.148301}, pages = {7}, year = {2022}, abstract = {We study a non-Markovian and nonstationary model of animal mobility incorporating both exploration and memory in the form of preferential returns. Exact results for the probability of visiting a given number of sites are derived and a practical WKB approximation to treat the nonstationary problem is developed. A mean-field version of this model, first suggested by Song et al., [Modelling the scaling properties of human mobility, Nat. Phys. 6, 818 (2010)] was shown to well describe human movement data. We show that our generalized model adequately describes empirical movement data of Egyptian fruit bats (Rousettus aegyptiacus) when accounting for interindividual variation in the population. We also study the probability of visiting any site a given number of times and derive a mean-field equation. Our analysis yields a remarkable phase transition occurring at preferential returns which scale linearly with past visits. Following empirical evidence, we suggest that this phase transition reflects a trade-off between extensive and intensive foraging modes.}, language = {en} } @article{VinkeGabryschPaolettietal.2020, author = {Vinke, Kira and Gabrysch, Sabine and Paoletti, Emanuela and Rockstr{\"o}m, Johan and Schellnhuber, Hans Joachim}, title = {Corona and the climate}, series = {Global sustainability}, volume = {3}, journal = {Global sustainability}, publisher = {Cambridge Univ. Press}, address = {Cambridge}, issn = {2059-4798}, doi = {10.1017/sus.2020.20}, pages = {7}, year = {2020}, abstract = {Lessons from the corona crisis can help manage the even more daunting challenge of anthropogenic global warming.}, language = {en} } @article{VinodCherstvyMetzleretal.2022, author = {Vinod, Deepak and Cherstvy, Andrey G. and Metzler, Ralf and Sokolov, Igor M.}, title = {Time-averaging and nonergodicity of reset geometric Brownian motion with drift}, series = {Physical review : E, Statistical, nonlinear and soft matter physics}, volume = {106}, journal = {Physical review : E, Statistical, nonlinear and soft matter physics}, number = {3}, publisher = {American Physical Society}, address = {College Park}, issn = {2470-0045}, doi = {10.1103/PhysRevE.106.034137}, pages = {36}, year = {2022}, abstract = {How do near-bankruptcy events in the past affect the dynamics of stock-market prices in the future? Specifically, what are the long-time properties of a time-local exponential growth of stock-market prices under the influence of stochastically occurring economic crashes? Here, we derive the ensemble- and time-averaged properties of the respective "economic" or geometric Brownian motion (GBM) with a nonzero drift exposed to a Poissonian constant-rate price-restarting process of "resetting." We examine-based both on thorough analytical calculations and on findings from systematic stochastic computer simulations-the general situation of reset GBM with a nonzero [positive] drift and for all special cases emerging for varying parameters of drift, volatility, and reset rate in the model. We derive and summarize all short- and long-time dependencies for the mean-squared displacement (MSD), the variance, and the mean time-averaged MSD (TAMSD) of the process of Poisson-reset GBM under the conditions of both rare and frequent resetting. We consider three main regions of model parameters and categorize the crossovers between different functional behaviors of the statistical quantifiers of this process. The analytical relations are fully supported by the results of computer simulations. In particular, we obtain that Poisson-reset GBM is a nonergodic stochastic process, with generally MSD(Delta) not equal TAMSD(Delta) and Variance(Delta) not equal TAMSD(Delta) at short lag times Delta and for long trajectory lengths T. We investigate the behavior of the ergodicity-breaking parameter in each of the three regions of parameters and examine its dependence on the rate of reset at Delta/T << 1. Applications of these theoretical results to the analysis of prices of reset-containing options are pertinent.}, language = {en} } @article{VinodCherstvyWangetal.2022, author = {Vinod, Deepak and Cherstvy, Andrey G. and Wang, Wei and Metzler, Ralf and Sokolov, Igor M.}, title = {Nonergodicity of reset geometric Brownian motion}, series = {Physical review : E, Statistical, nonlinear and soft matter physics}, volume = {105}, journal = {Physical review : E, Statistical, nonlinear and soft matter physics}, number = {1}, publisher = {American Physical Society}, address = {College Park}, issn = {2470-0045}, doi = {10.1103/PhysRevE.105.L012106}, pages = {4}, year = {2022}, abstract = {We derive. the ensemble-and time-averaged mean-squared displacements (MSD, TAMSD) for Poisson-reset geometric Brownian motion (GBM), in agreement with simulations. We find MSD and TAMSD saturation for frequent resetting, quantify the spread of TAMSDs via the ergodicity-breaking parameter and compute distributions of prices. General MSD-TAMSD nonequivalence proves reset GBM nonergodic.}, language = {en} } @article{VitaliSposiniSliusarenkoetal.2018, author = {Vitali, Silvia and Sposini, Vittoria and Sliusarenko, Oleksii and Paradisi, Paolo and Castellani, Gastone and Pagnini, Gianni}, title = {Langevin equation in complex media and anomalous diffusion}, series = {Interface : journal of the Royal Society}, volume = {15}, journal = {Interface : journal of the Royal Society}, number = {145}, publisher = {Royal Society}, address = {London}, issn = {1742-5689}, doi = {10.1098/rsif.2018.0282}, pages = {10}, year = {2018}, abstract = {The problem of biological motion is a very intriguing and topical issue. Many efforts are being focused on the development of novel modelling approaches for the description of anomalous diffusion in biological systems, such as the very complex and heterogeneous cell environment. Nevertheless, many questions are still open, such as the joint manifestation of statistical features in agreement with different models that can also be somewhat alternative to each other, e.g. continuous time random walk and fractional Brownian motion. To overcome these limitations, we propose a stochastic diffusion model with additive noise and linear friction force (linear Langevin equation), thus involving the explicit modelling of velocity dynamics. The complexity of the medium is parametrized via a population of intensity parameters (relaxation time and diffusivity of velocity), thus introducing an additional randomness, in addition to white noise, in the particle's dynamics. We prove that, for proper distributions of these parameters, we can get both Gaussian anomalous diffusion, fractional diffusion and its generalizations.}, language = {en} } @phdthesis{Vlasov2015, author = {Vlasov, Vladimir}, title = {Synchronization of oscillatory networks in terms of global variables}, url = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-78182}, school = {Universit{\"a}t Potsdam}, pages = {82}, year = {2015}, abstract = {Synchronization of large ensembles of oscillators is an omnipresent phenomenon observed in different fields of science like physics, engineering, life sciences, etc. The most simple setup is that of globally coupled phase oscillators, where all the oscillators contribute to a global field which acts on all oscillators. This formulation of the problem was pioneered by Winfree and Kuramoto. Such a setup gives a possibility for the analysis of these systems in terms of global variables. In this work we describe nontrivial collective dynamics in oscillator populations coupled via mean fields in terms of global variables. We consider problems which cannot be directly reduced to standard Kuramoto and Winfree models. In the first part of the thesis we adopt a method introduced by Watanabe and Strogatz. The main idea is that the system of identical oscillators of particular type can be described by a low-dimensional system of global equations. This approach enables us to perform a complete analytical analysis for a special but vast set of initial conditions. Furthermore, we show how the approach can be expanded for some nonidentical systems. We apply the Watanabe-Strogatz approach to arrays of Josephson junctions and systems of identical phase oscillators with leader-type coupling. In the next parts of the thesis we consider the self-consistent mean-field theory method that can be applied to general nonidentical globally coupled systems of oscillators both with or without noise. For considered systems a regime, where the global field rotates uniformly, is the most important one. With the help of this approach such solutions of the self-consistency equation for an arbitrary distribution of frequencies and coupling parameters can be found analytically in the parametric form, both for noise-free and noisy cases. We apply this method to deterministic Kuramoto-type model with generic coupling and an ensemble of spatially distributed oscillators with leader-type coupling. Furthermore, with the proposed self-consistent approach we fully characterize rotating wave solutions of noisy Kuramoto-type model with generic coupling and an ensemble of noisy oscillators with bi-harmonic coupling. Whenever possible, a complete analysis of global dynamics is performed and compared with direct numerical simulations of large populations.}, language = {en} } @article{VojtaSkinnerMetzler2019, author = {Vojta, Thomas and Skinner, Sarah and Metzler, Ralf}, title = {Probability density of the fractional Langevin equation with reflecting walls}, series = {Physical review : E, Statistical, nonlinear and soft matter physics}, volume = {100}, journal = {Physical review : E, Statistical, nonlinear and soft matter physics}, number = {4}, publisher = {American Physical Society}, address = {College Park}, issn = {2470-0045}, doi = {10.1103/PhysRevE.100.042142}, pages = {11}, year = {2019}, abstract = {We investigate anomalous diffusion processes governed by the fractional Langevin equation and confined to a finite or semi-infinite interval by reflecting potential barriers. As the random and damping forces in the fractional Langevin equation fulfill the appropriate fluctuation-dissipation relation, the probability density on a finite interval converges for long times towards the expected uniform distribution prescribed by thermal equilibrium. In contrast, on a semi-infinite interval with a reflecting wall at the origin, the probability density shows pronounced deviations from the Gaussian behavior observed for normal diffusion. If the correlations of the random force are persistent (positive), particles accumulate at the reflecting wall while antipersistent (negative) correlations lead to a depletion of particles near the wall. We compare and contrast these results with the strong accumulation and depletion effects recently observed for nonthermal fractional Brownian motion with reflecting walls, and we discuss broader implications.}, language = {en} } @article{VollbrechtBrus2020, author = {Vollbrecht, Joachim and Brus, Viktor V.}, title = {On charge carrier density in organic solar cells obtained via capacitance spectroscopy}, series = {Advanced electronic materials}, volume = {6}, journal = {Advanced electronic materials}, number = {10}, publisher = {Wiley}, address = {Hoboken}, issn = {2199-160X}, doi = {10.1002/aelm.202000517}, pages = {9}, year = {2020}, abstract = {The determination of the voltage-dependent density of free charge carriers via capacitance spectroscopy is considered an important step in the analysis of emerging photovoltaic technologies, such as organic and perovskite solar cells. In particular, an intimate knowledge of the density of free charge carriers is required for the determination of crucial parameters such as the effective mobility, charge carrier lifetime, nongeminate recombination coefficients, average extraction times, and competition factors. Hence, it is paramount to verify the validity of the commonly employed approaches to obtain the density of free charge carriers. The advantages, drawbacks, and limitations of the most common approaches are investigated in detail and strategies to mitigate misleading values are explored. To this end, two types of nonfullerene organic solar cells based on a PTB7-Th:ITIC-2F blend and a PM6:Y6 blend, respectively, are used as a case study to assess how subsequent analyses of the nongeminate recombination dynamics depend on the chosen approach to calculate the density of free charge carriers via capacitance spectroscopy.}, language = {en} } @article{VollbrechtBrus2020, author = {Vollbrecht, Joachim and Brus, Viktor V.}, title = {On the recombination order of surface recombination under open circuit conditions}, series = {Organic electronics : physics, materials and applications}, volume = {86}, journal = {Organic electronics : physics, materials and applications}, publisher = {Elsevier Science}, address = {Amsterdam [u.a.]}, issn = {1566-1199}, doi = {10.1016/j.orgel.2020.105905}, pages = {7}, year = {2020}, abstract = {Understanding the recombination dynamics of organic and perovskite solar cells has been a crucial prerequisite in the steadily increasing performance of these promising new types of photovoltaics. Surface recombination in particular has turned out to be one of the last remaining roadblocks, which specifically reduces the open circuit voltage. In this study, the relationship between the rate of surface recombination and the density of charge carriers is analyzed, revealing a cubic dependence between these two parameters. This hypothesis is then tested and verified with the recombination dynamics of an organic solar cell known to exhibit significant surface recombination and a high energy proton irradiated CH3NH3PbI3 pemvskite solar cell during white light illumination. Incidentally, these results can also explain recombination orders exceeding the commonly known threshold for bimolecular recombination that have been observed in some studies without the need for a charge carrier dependent bimolecular recombination coefficient.}, language = {en} } @article{VollbrechtTokmoldinSunetal.2022, author = {Vollbrecht, Joachim and Tokmoldin, Nurlan and Sun, Bowen and Brus, Viktor V. and Shoaee, Safa and Neher, Dieter}, title = {Determination of the charge carrier density in organic solar cells}, series = {Journal of applied physics}, volume = {131}, journal = {Journal of applied physics}, number = {22}, publisher = {American Institute of Physics}, address = {Melville, NY}, issn = {0021-8979}, doi = {10.1063/5.0094955}, pages = {18}, year = {2022}, abstract = {The increase in the performance of organic solar cells observed over the past few years has reinvigorated the search for a deeper understanding of the loss and extraction processes in this class of device. A detailed knowledge of the density of free charge carriers under different operating conditions and illumination intensities is a prerequisite to quantify the recombination and extraction dynamics. Differential charging techniques are a promising approach to experimentally obtain the charge carrier density under the aforementioned conditions. In particular, the combination of transient photovoltage and photocurrent as well as impedance and capacitance spectroscopy have been successfully used in past studies to determine the charge carrier density of organic solar cells. In this Tutorial, these experimental techniques will be discussed in detail, highlighting fundamental principles, practical considerations, necessary corrections, advantages, drawbacks, and ultimately their limitations. Relevant references introducing more advanced concepts will be provided as well. Therefore, the present Tutorial might act as an introduction and guideline aimed at new prospective users of these techniques as well as a point of reference for more experienced researchers. Published under an exclusive license by AIP Publishing.}, language = {en} } @unpublished{VolosevichMeister2000, author = {Volosevich, Alexandra and Meister, Claudia-Veronika}, title = {Nonlinear electrostatic ion-acoustic waves in the solar atmosphere}, url = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus-14968}, year = {2000}, abstract = {Basing on recent solar models, the excitation of ion-acoustic turbulence in the weaklycollisional, fully and partially-ionized regions of the solar atmosphere is investigated. Within the frame of hydrodynamics, conditions are found under which the heating of the plasma by ion-acoustic type waves is more effective than the Joule heating. Taking into account wave and Joule heating effects, a nonlinear differential equation is derived, which describes the evolution of nonlinear ion-acoustic waves in the collisional plasma.}, language = {en} } @unpublished{VolosevichMeister1998, author = {Volosevich, Alexandra V. and Meister, Claudia-Veronika}, title = {Nonlinear interaction of Farley-Buneman waves}, url = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus-14851}, year = {1998}, abstract = {The nonlinear interaction of waves excited by the modified two-stream instability (Farley-Buneman instability) is considered. It is found that, during the linear stage of wave growth, the enhanced pressure of the high-frequency part of the waves locally generates a ponderomotive force. This force acts on the plasma particles and redistributes them. Thus an additional electrostatic polarization field occurs, which influences the low-frequency part of the waves. Then, the low-frequency waves also cause a redistribution of the high-frequency waves. In the paper, a self-consistent system of equations is obtained, which describes the nonlinear interaction of the waves. It is shown that the considered mechanism of wave interaction causes a nonlinear stabilization of the high-frequency waves' growth and a formation of local density structures of the charged particles. The density modifications of the charged particles during the non-linear stage of wave growth and the possible interval of aspect angles of the high-frequency waves are estimated.}, language = {en} } @phdthesis{vonNordheim2018, author = {von Nordheim, Danny}, title = {Dielectric non-linearities of P(VDF-TrFE) single and multilayers for memory applications}, url = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-421778}, school = {Universit{\"a}t Potsdam}, pages = {XVI, 109}, year = {2018}, abstract = {Poly(vinylidene fluoride-trifluoroethylene) (P(VDF-TrFE)) ferroelectric thin films of different molar ratio have been studied with regard to data memory applications. Therefore, films with thicknesses of 200 nm and less have been spin coated from solution. Observations gained from single layers have been extended to multilayer capacitors and three terminal transistor devices. Besides conventional hysteresis measurements, the measurement of dielectric non-linearities has been used as a main tool of characterisation. Being a very sensitive and non-destructive method, non-linearity measurements are well suited for polarisation readout and property studies. Samples have been excited using a high quality, single-frequency sinusoidal voltage with an amplitude significantly smaller than the coercive field of the samples. The response was then measured at the excitation frequency and its higher harmonics. Using the measurement results, the linear and non-linear dielectric permittivities ɛ₁, ɛ₂ and ɛ₃ have been determined. The permittivities have been used to derive the temperature-dependent polarisation behaviour as well as the polarisation state and the order of the phase transitions. The coercive field in VDF-TrFE copolymers is high if compared to their ceramic competitors. Therefore, the film thickness had to be reduced significantly. Considering a switching voltage of 5 V and a coercive field of 50 MV/m, the film thickness has to be 100 nm and below. If the thickness becomes substantially smaller than the other dimensions, surface and interface layer effects become more pronounced. For thicker films of P(VDF-TrFE) with a molar fraction of 56/44 a second-order phase transition without a thermal hysteresis for an ɛ₁(T) temperature cycle has been predicted and observed. This however, could not be confirmed by the measurements of thinner films. A shift of transition temperatures as well as a temperature independent, non-switchable polarisation and a thermal hysteresis for P(VDF-TrFE) 56/44 have been observed. The impact of static electric fields on the polarisation and the phase transition has therefore been studied and simulated, showing that all aforementioned phenomena including a linear temperature dependence of the polarisation might originate from intrinsic electric fields. In further experiments the knowledge gained from single layer capacitors has been extended to bilayer copolymer thin films of different molar composition. Bilayers have been deposited by succeeding cycles of spin coating from solution. Single layers and their bilayer combination have been studied individually in order to prove the layers stability. The individual layers have been found to be physically stable. But while the bilayers reproduced the main ɛ₁(T) properties of the single layers qualitatively, quantitative numbers could not be explained by a simple serial connection of capacitors. Furthermore, a linear behaviour of the polarisation throughout the measured temperature range has been observed. This was found to match the behaviour predicted considering a constant electric field. Retention time is an important quantity for memory applications. Hence, the retention behaviour of VDF-TrFE copolymer thin films has been determined using dielectric non-linearities. The polarisation loss in P(VDF-TrFE) poled samples has been found to be less than 20\% if recorded over several days. The loss increases significantly if the samples have been poled with lower amplitudes, causing an unsaturated polarisation. The main loss was attributed to injected charges. Additionally, measurements of dielectric non-linearities have been proven to be a sensitive and non-destructive tool to measure the retention behaviour. Finally, a ferroelectric field effect transistor using mainly organic materials (FerrOFET) has been successfully studied. DiNaphtho[2,3-b:2',3'-f]Thieno[3,2-b]Thiophene (DNTT) has proven to be a stable, suitable organic semiconductor to build up ferroelectric memory devices. Furthermore, an oxidised aluminium bottom electrode and additional dielectric layers, i.e. parylene C, have proven to reduce the leakage current and therefore enhance the performance significantly.}, language = {en} } @article{vonZanderSaalfrank2020, author = {von Zander, Robert Edler and Saalfrank, Peter}, title = {On the borate-catalyzed electrochemical reduction of phosphine oxide}, series = {The journal of physical chemistry : A, Molecules, spectroscopy, kinetics, environment \& general theory}, volume = {124}, journal = {The journal of physical chemistry : A, Molecules, spectroscopy, kinetics, environment \& general theory}, number = {49}, publisher = {American Chemical Society}, address = {Washington}, issn = {1089-5639}, doi = {10.1021/acs.jpca.0c07805}, pages = {10239 -- 10245}, year = {2020}, abstract = {Recently, Nocera and co-workers (J. Am. Chem. Soc. 2018, 140, 13711) demonstrated that triaryl borate Lewis acids facilitate the direct electrochemical reduction of triphenylphosphine oxide (TPPO) to triphenylphosphine (TPP). In the present contribution, we report a quantum chemical study unravelling details of the reaction, which also supports the proposed ECrECi mechanism. Alternative electrochemical routes to TPPO reduction facilitated by other Lewis acids (CH3+), or by photocatalysis at semiconductor surfaces, are also briefly discussed.}, language = {en} } @phdthesis{Voroshnin2023, author = {Voroshnin, Vladimir}, title = {Control over spin and electronic structure of MoS₂ monolayer via interactions with substrates}, doi = {10.25932/publishup-59070}, url = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-590709}, school = {Universit{\"a}t Potsdam}, pages = {viii, 125}, year = {2023}, abstract = {The molybdenum disulfide (MoS2) monolayer is a semiconductor with a direct bandgap while it is a robust and affordable material. It is a candidate for applications in optoelectronics and field-effect transistors. MoS2 features a strong spin-orbit coupling which makes its spin structure promising for acquiring the Kane-Mele topological concept with corresponding applications in spintronics and valleytronics. From the optical point of view, the MoS2 monolayer features two valleys in the regions of K and K' points. These valleys are differentiated by opposite spins and a related valley-selective circular dichroism. In this study we aim to manipulate the MoS2 monolayer spin structure in the vicinity of the K and K' points to explore the possibility of getting control over the optical and electronic properties. We focus on two different substrates to demonstrate two distinct routes: a gold substrate to introduce a Rashba effect and a graphene/cobalt substrate to introduce a magnetic proximity effect in MoS2. The Rashba effect is proportional to the out-of-plane projection of the electric field gradient. Such a strong change of the electric field occurs at the surfaces of a high atomic number materials and effectively influence conduction electrons as an in-plane magnetic field. A molybdenum and a sulfur are relatively light atoms, thus, similar to many other 2D materials, intrinsic Rashba effect in MoS2 monolayer is vanishing small. However, proximity of a high atomic number substrate may enhance Rashba effect in a 2D material as it was demonstrated for graphene previously. Another way to modify the spin structure is to apply an external magnetic field of high magnitude (several Tesla), and cause a Zeeman splitting, the conduction electrons. However, a similar effect can be reached via magnetic proximity which allows us to reduce external magnetic fields significantly or even to zero. The graphene on cobalt interface is ferromagnetic and stable for MoS2 monolayer synthesis. Cobalt is not the strongest magnet; therefore, stronger magnets may lead to more significant results. Nowadays most experimental studies on the dichalcogenides (MoS2 included) are performed on encapsulated heterostructures that are produced by mechanical exfoliation. While mechanical exfoliation (or scotch-tape method) allows to produce a huge variety of structures, the shape and the size of the samples as well as distance between layers in heterostructures are impossible to control reproducibly. In our study we used molecular beam epitaxy (MBE) methods to synthesise both MoS2/Au(111) and MoS2/graphene/Co systems. We chose to use MBE, as it is a scalable and reproducible approach, so later industry may adapt it and take over. We used graphene/cobalt instead of just a cobalt substrate because direct contact of MoS2\ monolayer and a metallic substrate may lead to photoluminescence (PL) quenching in the metallic substrate. Graphene and hexagonal boron nitride monolayer are considered building blocks of a new generation of electronics also commonly used as encapsulating materials for PL studies. Moreover graphene is proved to be a suitable substrate for the MBE growth of transitional metal dichalcogenides (TMDCs). In chapter 1, we start with an introduction to TMDCs. Then we focus on MoS2 monolayer state of the art research in the fields of application scenario; synthesis approaches; electronic, spin, and optical properties; and interactions with magnetic fields and magnetic materials. We briefly touch the basics of magnetism in solids and move on to discuss various magnetic exchange interactions and magnetic proximity effect. Then we describe MoS2 optical properties in more detail. We start from basic exciton physics and its manifestation in the MoS2 monolayer. We consider optical selection rules in the MoS2 monolayer and such properties as chirality, spin-valley locking, and coexistence of bright and dark excitons. Chapter 2 contains an overview of the employed surface science methods: angle-integrated, angle-resolved, and spin-resolved photoemission; low energy electron diffraction and scanning tunneling microscopy. In chapter 3, we describe MoS2 monolayer synthesis details for two substrates: gold monocrystal with (111) surface and graphene on cobalt thin film with Co(111) surface orientation. The synthesis descriptions are followed by a detailed characterisation of the obtained structures: fingerprints of MoS2 monolayer formation; MoS2 monolayer symmetry and its relation to the substrate below; characterisation of MoS2 monolayer coverage, domain distribution, sizes and shapes, and moire structures. In chapter~4, we start our discussion with MoS2/Au(111) electronic and spin structure. Combining density functional theory computations (DFT) and spin-resolved photoemission studies, we demonstrate that the MoS2 monolayer band structure features an in-plane Rashba spin splitting. This confirms the possibility of MoS2 monolayer spin structure manipulation via a substrate. Then we investigate the influence of a magnetic proximity in the MoS2/graphene/Co system on the MoS2 monolayer spin structure. We focus our investigation on MoS2 high symmetry points: G and K. First, using spin-resolved measurements, we confirm that electronic states are spin-split at the G point via a magnetic proximity effect. Second, combining spin-resolved measurements and DFT computations for MoS2 monolayer in the K point region, we demonstrate the appearance of a small in-plane spin polarisation in the valence band top and predict a full in-plane spin polarisation for the conduction band bottom. We move forward discussing how these findings are related to the MoS2 monolayer optical properties, in particular the possibility of dark exciton observation. Additionally, we speculate on the control of the MoS2 valley energy via magnetic proximity from cobalt. As graphene is spatially buffering the MoS2 monolayer from the Co thin film, we speculate on the role of graphene in the magnetic proximity transfer by replacing graphene with vacuum and other 2D materials in our computations. We finish our discussion by investigating the K-doped MoS2/graphene/Co system and the influence of this doping on the electronic and spin structure as well as on the magnetic proximity effect. In summary, using a scalable MBE approach we synthesised MoS2/Au(111) and MoS2/graphene/Co systems. We found a Rashba effect taking place in MoS2/Au(111) which proves that the MoS2 monolayer in-plane spin structure can be modified. In MoS2/graphene/Co the in-plane magnetic proximity effect indeed takes place which rises the possibility of fine tuning the MoS2 optical properties via manipulation of the the substrate magnetisation.}, language = {en} } @article{VoroshninTarasovBokaietal.2022, author = {Voroshnin, Vladimir and Tarasov, Artem V. and Bokai, Kirill A. and Chikina, Alla and Senkovskiy, Boris V. and Ehlen, Niels and Usachov, Dmitry Yu. and Gruneis, Alexander and Krivenkov, Maxim and Sanchez-Barriga, Jaime and Fedorov, Alexander}, title = {Direct spectroscopic evidence of magnetic proximity effect in MoS2 monolayer on graphene/Co}, series = {ACS nano}, volume = {16}, journal = {ACS nano}, number = {5}, publisher = {American Chemical Society}, address = {Washington}, issn = {1936-0851}, doi = {10.1021/acsnano.1c10391}, pages = {7448 -- 7456}, year = {2022}, abstract = {A magnetic field modifies optical properties and provides valley splitting in a molybdenum disulfide (MoS2) monolayer. Here we demonstrate a scalable approach to the epitaxial synthesis of MoS2 monolayer on a magnetic graphene/Co system. Using spin- and angle-resolved photoemission spectroscopy we observe a magnetic proximity effect that causes a 20 meV spin-splitting at the (Gamma) over bar point and canting of spins at the (K) over bar point in the valence band toward the in-plane direction of cobalt magnetization. Our density functional theory calculations reveal that the in-plane spin component at (K) over bar is localized on Co atoms in the valence band, while in the conduction band it is localized on the MoS2 layer. The calculations also predict a 16 meV spin-splitting at the (Gamma) over bar point and 8 meV (K) over bar-(K) over bar' valley asymmetry for an out-of-plane magnetization. These findings suggest control over optical transitions in MoS2 via Co magnetization. Our estimations show that the magnetic proximity effect is equivalent to the action of the magnetic field as large as 100 T.}, language = {en} } @unpublished{VossKurthsSchwarz1996, author = {Voss, Henning and Kurths, J{\"u}rgen and Schwarz, Udo}, title = {Reconstruction of grand minima of solar activity from Delta 14 C data : linear and nonlinear signal analysis}, url = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus-14083}, year = {1996}, abstract = {Using a special technique of data analysis, we have found out 34 grand minima of solar activity obtained from a 7,700 years long Δ14C record. The method used rests on a proper filtering of the Δ14C record and the extrapolation of verifiable results for the later history back in time. Additionally, we use a method of nonlinear dynamics, the recurrence rate, to back up the results. Our findings are not contradictory to the record of solar maxima resp. minima by Eddy [5], but constitute a considerable extension. Hence, it has become possible to look closer at the validity of models. This way, we have tested several models for solar activity, esp. the model of Barnes et al. [1]. There are hints for that the grand minima might solely be driven by the 209 year period found in the Δ14C record.}, language = {en} } @phdthesis{Vu2022, author = {Vu, Nils Leif}, title = {A task-based parallel elliptic solver for numerical relativity with discontinuous Galerkin methods}, doi = {10.25932/publishup-56226}, url = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-562265}, school = {Universit{\"a}t Potsdam}, pages = {172}, year = {2022}, abstract = {Elliptic partial differential equations are ubiquitous in physics. In numerical relativity---the study of computational solutions to the Einstein field equations of general relativity---elliptic equations govern the initial data that seed every simulation of merging black holes and neutron stars. In the quest to produce detailed numerical simulations of these most cataclysmic astrophysical events in our Universe, numerical relativists resort to the vast computing power offered by current and future supercomputers. To leverage these computational resources, numerical codes for the time evolution of general-relativistic initial value problems are being developed with a renewed focus on parallelization and computational efficiency. Their capability to solve elliptic problems for accurate initial data must keep pace with the increasing detail of the simulations, but elliptic problems are traditionally hard to parallelize effectively. In this thesis, I develop new numerical methods to solve elliptic partial differential equations on computing clusters, with a focus on initial data for orbiting black holes and neutron stars. I develop a discontinuous Galerkin scheme for a wide range of elliptic equations, and a stack of task-based parallel algorithms for their iterative solution. The resulting multigrid-Schwarz preconditioned Newton-Krylov elliptic solver proves capable of parallelizing over 200 million degrees of freedom to at least a few thousand cores, and already solves initial data for a black hole binary about ten times faster than the numerical relativity code SpEC. I also demonstrate the applicability of the new elliptic solver across physical disciplines, simulating the thermal noise in thin mirror coatings of interferometric gravitational-wave detectors to unprecedented accuracy. The elliptic solver is implemented in the new open-source SpECTRE numerical relativity code, and set up to support simulations of astrophysical scenarios for the emerging era of gravitational-wave and multimessenger astronomy.}, language = {en} } @phdthesis{Wagle2019, author = {Wagle, Swapnil}, title = {Multi scale modeling of SNARE-mimetic peptides for their applications in membrane fusion}, pages = {105}, year = {2019}, language = {en} } @article{WaldripNivenAbeletal.2017, author = {Waldrip, S. H. and Niven, Robert K. and Abel, Markus and Schlegel, M.}, title = {Reduced-Parameter Method for Maximum Entropy Analysis of Hydraulic Pipe Flow Networks}, series = {Journal of hydraulic engineering}, volume = {144}, journal = {Journal of hydraulic engineering}, number = {2}, publisher = {American Society of Civil Engineers}, address = {Reston}, issn = {0733-9429}, doi = {10.1061/(ASCE)HY.1943-7900.0001379}, pages = {10}, year = {2017}, abstract = {A maximum entropy (MaxEnt) method is developed to predict flow rates or pressure gradients in hydraulic pipe networks without sufficient information to give a closed-form (deterministic) solution. This methodology substantially extends existing deterministic flow network analysis methods. It builds on the MaxEnt framework previously developed by the authors. This study uses a continuous relative entropy defined on a reduced parameter set, here based on the external flow rates. This formulation ensures consistency between different representations of the same network. The relative entropy is maximized subject to observable constraints on the mean values of a subset of flow rates or potential differences, the frictional properties of each pipe, and physical constraints arising from Kirchhoff's first and second laws. The new method is demonstrated by application to a simple one-loop network and a 1,123-node, 1,140-pipe water distribution network in the suburb of Torrens, Australian Capital Territory, Australia.}, language = {en} } @misc{WaldripNivenAbeletal.2017, author = {Waldrip, Steven H. and Niven, Robert K. and Abel, Markus and Schlegel, Michael}, title = {Consistent maximum entropy representations of pipe flow networks}, series = {AIP conference proceedings}, volume = {1853}, journal = {AIP conference proceedings}, number = {1}, publisher = {American Institute of Physics}, address = {Melville}, isbn = {978-0-7354-1527-0}, issn = {0094-243X}, doi = {10.1063/1.4985365}, year = {2017}, abstract = {The maximum entropy method is used to predict flows on water distribution networks. This analysis extends the water distribution network formulation of Waldrip et al. (2016) Journal of Hydraulic Engineering (ASCE), by the use of a continuous relative entropy defined on a reduced parameter set. This reduction in the parameters that the entropy is defined over ensures consistency between different representations of the same network. The performance of the proposed reduced parameter method is demonstrated with a one-loop network case study.}, language = {en} } @misc{WaldripNivenAbeletal.2017, author = {Waldrip, Steven H. and Niven, Robert K. and Abel, Markus and Schlegel, Michael}, title = {Maximum entropy analysis of transport networks}, series = {AIP conference proceedings}, volume = {1853}, journal = {AIP conference proceedings}, number = {1}, publisher = {American Institute of Physics}, address = {Melville}, isbn = {978-0-7354-1527-0}, issn = {0094-243X}, doi = {10.1063/1.4985364}, pages = {8}, year = {2017}, abstract = {The maximum entropy method is used to derive an alternative gravity model for a transport network. The proposed method builds on previous methods which assign the discrete value of a maximum entropy distribution to equal the traffic flow rate. The proposed method however, uses a distribution to represent each flow rate. The proposed method is shown to be able to handle uncertainty in a more elegant way and give similar results to traditional methods. It is able to incorporate more of the observed data through the entropy function, prior distribution and integration limits potentially allowing better inferences to be made.}, language = {en} } @article{WalkerBoyntonShpritsetal.2022, author = {Walker, Simon N. and Boynton, Richard J. and Shprits, Yuri and Balikhin, Michael A. and Drozdov, Alexander}, title = {Forecast of the energetic electron environment of the radiation belts}, series = {Space Weather: The International Journal of Research and Applications}, volume = {20}, journal = {Space Weather: The International Journal of Research and Applications}, number = {12}, publisher = {American Geophysical Union}, address = {Washington}, issn = {1542-7390}, doi = {10.1029/2022SW003124}, pages = {21}, year = {2022}, abstract = {Different modeling methodologies possess different strengths and weakness. For instance, data based models may provide superior accuracy but have a limited spatial coverage while physics based models may provide lower accuracy but provide greater spatial coverage. This study investigates the coupling of a data based model of the electron fluxes at geostationary orbit (GEO) with a numerical model of the radiation belt region to improve the resulting forecasts/pastcasts of electron fluxes over the whole radiation belt region. In particular, two coupling methods are investigated. The first assumes an average value for L* for GEO, namely LGEO* L-GEO* = 6.2. The second uses a value of L* that varies with geomagnetic activity, quantified using the Kp index. As the terrestrial magnetic field responds to variations in geomagnetic activity, the value of L* will vary for a specific location. In this coupling method, the value of L* is calculated using the Kp driven Tsyganenko 89c magnetic field model for field line tracing. It is shown that this addition can result in changes in the initialization of the parameters at the Versatile Electron Radiation Belt model outer boundary. Model outputs are compared to Van Allen Probes MagEIS measurements of the electron fluxes in the inner magnetosphere for the March 2015 geomagnetic storm. It is found that the fixed LGEO* L-GEO* coupling method produces a more realistic forecast.}, language = {en} } @article{WangShpritsZhelayskayaetal.2019, author = {Wang, Dedong and Shprits, Yuri and Zhelayskaya, Irina S. and Agapitov, Oleksiy and Drozdov, Alexander and Aseev, Nikita}, title = {Analytical chorus wave model derived from van Allen Probe Observations}, series = {Journal of geophysical research : Space physics}, volume = {124}, journal = {Journal of geophysical research : Space physics}, number = {2}, publisher = {American Geophysical Union}, address = {Washington}, issn = {2169-9380}, doi = {10.1029/2018JA026183}, pages = {1063 -- 1084}, year = {2019}, abstract = {Chorus waves play an important role in the dynamic evolution of energetic electrons in the Earth's radiation belts and ring current. Using more than 5 years of Van Allen Probe data, we developed a new analytical model for upper-band chorus (UBC; 0.5fce < f < fce) and lower-band chorus (LBC; 0.05fce < f < 0.5fce) waves, where fce is the equatorial electron gyrofrequency. By applying polynomial fits to chorus wave root mean square amplitudes, we developed regression models for LBC and UBC as a function of geomagnetic activity (Kp), L, magnetic latitude (λ), and magnetic local time (MLT). Dependence on Kp is separated from the dependence on λ, L, and MLT as Kp-scaling law to simplify the calculation of diffusion coefficients and inclusion into particle tracing codes. Frequency models for UBC and LBC are also developed, which depends on MLT and magnetic latitude. This empirical model is valid in all MLTs, magnetic latitude up to 20°, Kp ≤ 6, L-shell range from 3.5 to 6 for LBC and from 4 to 6 for UBC. The dependence of root mean square amplitudes on L are different for different bands, which implies different energy sources for different wave bands. This analytical chorus wave model is convenient for inclusion in quasi-linear diffusion calculations of electron scattering rates and particle simulations in the inner magnetosphere, especially for the newly developed four-dimensional codes, which require significantly improved wave parameterizations.}, language = {en} } @article{WangZhangYanetal.2022, author = {Wang, Feipeng and Zhang, Zheng and Yan, Yuyang and Shen, Zijia and Wang, Qiang and Gerhard, Reimund}, title = {Surface reconstruction on electro-spun PVA/PVP nanofibers by water evaporation}, series = {Nanomaterials}, volume = {12}, journal = {Nanomaterials}, number = {5}, publisher = {MDPI}, address = {Basel}, issn = {2079-4991}, doi = {10.3390/nano12050797}, pages = {7}, year = {2022}, abstract = {Tailoring the secondary surface morphology of electro-spun nanofibers has been highly desired, as such delicate structures equip nanofibers with distinct functions. Here, we report a simple strategy to directly reconstruct the surface of polyvinyl alcohol/polyvinylpyrrolidone (PVA/PVP) nanofibers by water evaporation. The roughness and diameter of the nanofibers depend on the temperature during vacuum drying. Surface changes of the nanofibers from smooth to rough were observed at 55 degrees C, with a significant drop in nanofiber diameter. We attribute the formation of the secondary surface morphology to the intermolecular forces in the water vapor, including capillary and the compression forces, on the basis of the results from the Fourier-transform infrared (FTIR) and X-ray photoelectron (XPS) spectroscopy. The strategy is universally effective for various electro-spun polymer nanofibers, thus opening up avenues toward more detailed and sophisticated structure design and implementation for nanofibers.}, language = {en} } @phdthesis{Wang2020, author = {Wang, Jingwen}, title = {Electret properties of polypropylene with surface chemical modification and crystalline reconstruction}, doi = {10.25932/publishup-47027}, url = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-470271}, school = {Universit{\"a}t Potsdam}, pages = {vi, 121}, year = {2020}, abstract = {As one of the most-produced commodity polymers, polypropylene draws considerable scientific and commercial interest as an electret material. In the present thesis, the influence of the surface chemical modification and crystalline reconstruction on the electret properties of the polypropylene thin films will be discussed. The chemical treatment with orthophosphoric acid can significantly improve the surface charge stability of the polypropylene electrets by introducing phosphorus- and oxygen-containing structures onto the modified surface. The thermally stimulated discharge measurement and charge profiling by means of piezoelectrically generated pressure steps are used to investigate the electret behaviour. It is concluded that deep traps of limited number density are created during the treatment with inorganic chemicals. Hence, the improvement dramatically decreases when the surface-charge density is substantially higher than ±1.2×10^(-3) C·m^(-2). The newly formed traps also show a higher trapping energy for negative charges. The energetic distributions of the traps in the non-treated and chemically treated samples offer an insight regarding the surface and foreign-chemical dominance on the charge storage and transport in the polypropylene electrets. Additionally, different electret properties are observed on the polypropylene films with the spherulitic and transcrystalline structures. It indicates the dependence of the charge storage and transport on the crystallite and molecular orientations in the crystalline phase. In general, a more diverse crystalline growth in the spherulitic samples can result in a more complex energetic trap distribution, in comparison to that in a transcrystalline polypropylene. The double-layer transcrystalline polypropylene film with a crystalline interface in the middle can be obtained by crystallising the film in contact with rough moulding surfaces on both sides. A layer of heterocharges appears on each side of the interface in the double-layer transcrystalline polypropylene electrets after the thermal poling. However, there is no charge captured within the transcrystalline layers. The phenomenon reveals the importance of the crystalline interface in terms of creating traps with the higher activation energy in polypropylene. The present studies highlight the fact that even slight variations in the polypropylene film may lead to dramatic differences in its electret properties.}, language = {en} } @misc{WangRychkovGerhard2018, author = {Wang, Jingwen and Rychkov, Dmitry and Gerhard, Reimund}, title = {Influence of Charge Density on Charge Decay in Chemically Modified Polypropylene Films}, series = {2018 IEEE 2nd International Conference on Dielectrics (ICD)}, journal = {2018 IEEE 2nd International Conference on Dielectrics (ICD)}, publisher = {IEEE}, address = {New York}, isbn = {978-1-5386-6389-9}, doi = {10.1109/ICD.2018.8514718}, pages = {4}, year = {2018}, abstract = {Previous work has shown that surface modification with orthophosphoric acid can significantly enhance the charge stability on polypropylene (PP) surface by generating deeper traps. In the present study, thermally stimulated potential-decay measurements revealed that the chemical treatment may also significantly increase the number of available trapping sites on the surface. Thus, as a consequence, the so-called "cross-over" phenomenon, which is observed on as-received and thermally treated PP electrets, may be overcome in a certain range of initial charge densities. Furthermore, the discharge behavior of chemically modified samples indicates that charges can be injected from the treated surface into the bulk, and/or charges of opposite polarity can be pulled from the rear electrode into the bulk at elevated temperatures and at the high electric fields that are caused by the deposited charges. In the bulk, a lack of deep traps causes rapid charge decay already in the temperature range around 95 degrees C.}, language = {en} } @article{WangRychkovGerhard2021, author = {Wang, Jingwen and Rychkov, Dmitry and Gerhard, Reimund}, title = {Space-charge electret properties of polypropylene films with transcrystalline or spherulitic structures}, series = {Journal of applied physics : AIP's archival journal for significant new results in applied physics / publ. by the American Institute of Physics}, volume = {129}, journal = {Journal of applied physics : AIP's archival journal for significant new results in applied physics / publ. by the American Institute of Physics}, number = {6}, publisher = {American Institute of Physics}, address = {Melville}, issn = {0021-8979}, doi = {10.1063/5.0039867}, pages = {7}, year = {2021}, abstract = {Spherulite-related space-charge electret properties of polypropylene (PP) have been widely discussed in the past decades. In the present paper, a less-common crystalline structure in PP-transcrystalline PP-is studied regarding its electret behavior in comparison with the typical spherulitic morphology. Polarized light microscopy and differential scanning calorimetry were employed to characterize the crystallite types and crystallinities of transcrystalline and spherulitic PP. Their electret functionality is investigated by means of thermally stimulated discharge experiments, where the cross-over phenomenon is observed on transcrystalline PP films, whereas surface-potential saturation and undercharging on the surface occur on the spherulitic samples. Besides, an asymmetrical behavior of positive and negative surface-charge stabilities is found on PP with spherulites, the negatively charged spherulitic surfaces show a better charge stability. It is shown that PP electrets are very sensitive to changes in the microscopic crystalline structures and their interfaces as well as in the molecular conformations controlled through adjustments of the respective processing steps. In addition, surface and bulk nanocomposites of PP or low-density polyethylene with inorganic particles are included in the comparison. In view of recent developments in the areas of PP-based electret-fiber filters and cellular-foam ferroelectrets, the observed changes in the charge-storage properties may have particular relevance, as the required film, fiber, or foam processing might significantly modify crystalline morphologies and nano-scale interfaces in PP electrets. Limitations in the charge-storage capabilities of interface structures may also be of interest in the context of high-voltage electrical-insulation materials where reduced space-charge accumulation and slightly increased charge transport can be advantageous.}, language = {en} } @article{WangRychkovNguyenetal.2020, author = {Wang, Jingwen and Rychkov, Dmitry and Nguyen, Quyet Doan and Gerhard, Reimund}, title = {The influence of orthophosphoric-acid surface modification on charge-storage enhancement in polypropylene electrets}, series = {Journal of applied physics}, volume = {128}, journal = {Journal of applied physics}, number = {3}, publisher = {American Institute of Physics}, address = {Melville}, issn = {0021-8979}, doi = {10.1063/5.0013805}, pages = {6}, year = {2020}, abstract = {Bipolar electrets from polypropylene (PP) are essential, e.g., in electret air filters and in cellular-foam ferroelectrets. Therefore, the mechanism of surface-charge stability enhancement on PP electrets via orthophosphoric-acid surface treatment is investigated in detail. It is shown that the significant charge-stability enhancement can be mainly attributed to deeper surface traps originating from deposited chemicals and topographic features on the modified surfaces. Thermally stimulated discharge of chemically treated and non-treated PP films with different surface-charge densities is used to test the limits of the newly formed deep traps in terms of the capacity for hosting surface charges. When the initial surface-charge density is very high, more charges are forced into shallower original traps on the surface or in the bulk of the treated PP samples, reducing the effect of the deeper surface traps brought by the surface modification. The well-known crossover phenomenon (of the surface-charge decay curves) has been observed between modified PP electrets charged to +/- 2kV and to +/- 3kV. Acoustically probed charge distributions in the thickness direction of PP electrets at different stages of thermal discharging indicate that the deep surface trapping sites may have preference for negative charges, resulting in the observed asymmetric charge stability of the modified PP films.}, language = {en} } @article{WangRychkovNguyenetal.2020, author = {Wang, Jingwen and Rychkov, Dmitry and Nguyen, Quyet Doan and Gerhard, Reimund}, title = {Unexpected bipolar space-charge polarization across transcrystalline interfaces in polypropylene electret films}, series = {Journal of applied physics}, volume = {128}, journal = {Journal of applied physics}, number = {13}, publisher = {American Institute of Physics, AIP}, address = {Melville, NY}, issn = {0021-8979}, doi = {10.1063/5.0022071}, pages = {7}, year = {2020}, abstract = {A double-layer transcrystalline polypropylene (PP) film with a flat central interface layer between its two transcrystalline layers is obtained by recrystallization from the melt between two polytetrafluoroethylene (PTFE) surfaces on both sides of the PP film. Its electret properties are studied and compared with those of a single-layer transcrystalline PP film re-crystallized in contact with only one PTFE surface. Within experimental uncertainty, the two types of transcrystalline films exhibit the same thermal properties and crystallinities. After thermal poling, however, two hetero-charge layers of opposite polarity are found on the internal interfaces of the double-layer transcrystalline films and may together be considered as micrometer-sized dipoles. The unexpected phenomenon does not occur in single-layer transcrystalline samples without a central interface layer, suggesting that the interfaces between the transcrystalline layers and the micrometer-thick central interface layer may be the origin of deeper traps rather than the crystalline structures in the transcrystallites or the spherulites. The origin of the interfacial charges was also studied by means of an injection-blocking charging method, which revealed that intrinsic charge carriers introduced during recrystallization are most likely responsible for the interfacial charges. It is fascinating that a material as familiar as PP can exhibit such intriguing properties with a special bipolar space-charge polarization across the central interface layer after quasi-epitaxial surface moulding into a double-layer transcrystalline form. In addition to applications in electret (micro-)devices for electro-mechanical transduction, the highly ordered structures may also be employed as a new paradigm for studying charge storage and transport in polymer electrets and in dielectrics for DC electrical insulation.}, language = {en} } @article{WangMosconiWolffetal.2019, author = {Wang, Qiong and Mosconi, Edoardo and Wolff, Christian Michael and Li, Junming and Neher, Dieter and De Angelis, Filippo and Suranna, Gian Paolo and Grisorio, Roberto and Abate, Antonio}, title = {Rationalizing the molecular design of hole-selective contacts to improve charge extraction in Perovskite solar cells}, series = {dvanced energy materials}, volume = {9}, journal = {dvanced energy materials}, number = {28}, publisher = {Wiley-VCH}, address = {Weinheim}, issn = {1614-6832}, doi = {10.1002/aenm.201900990}, pages = {9}, year = {2019}, abstract = {Two new hole selective materials (HSMs) based on dangling methylsulfanyl groups connected to the C-9 position of the fluorene core are synthesized and applied in perovskite solar cells. Being structurally similar to a half of Spiro-OMeTAD molecule, these HSMs (referred as FS and DFS) share similar redox potentials but are endowed with slightly higher hole mobility, due to the planarity and large extension of their structure. Competitive power conversion efficiency (up to 18.6\%) is achieved by using the new HSMs in suitable perovskite solar cells. Time-resolved photoluminescence decay measurements and electrochemical impedance spectroscopy show more efficient charge extraction at the HSM/perovskite interface with respect to Spiro-OMeTAD, which is reflected in higher photocurrents exhibited by DFS/FS-integrated perovskite solar cells. Density functional theory simulations reveal that the interactions of methylammonium with methylsulfanyl groups in DFS/FS strengthen their electrostatic attraction with the perovskite surface, providing an additional path for hole extraction compared to the sole presence of methoxy groups in Spiro-OMeTAD. Importantly, the low-cost synthesis of FS makes it significantly attractive for the future commercialization of perovskite solar cells.}, language = {en} } @article{WangSmithSkroblinetal.2020, author = {Wang, Qiong and Smith, Joel A. and Skroblin, Dieter and Steele, Julian A. and Wolff, Christian Michael and Caprioglio, Pietro and Stolterfoht, Martin and K{\"o}bler, Hans and Turren-Cruz, Silver-Hamill and Li, Meng and Gollwitzer, Christian and Neher, Dieter and Abate, Antonio}, title = {Managing phase purities and crystal orientation for high-performance and photostable cesium lead halide perovskite solar cells}, series = {Solar RRL}, volume = {4}, journal = {Solar RRL}, number = {9}, publisher = {WILEY-VCH}, address = {Weinheim}, pages = {9}, year = {2020}, abstract = {Inorganic perovskites with cesium (Cs+) as the cation have great potential as photovoltaic materials if their phase purity and stability can be addressed. Herein, a series of inorganic perovskites is studied, and it is found that the power conversion efficiency of solar cells with compositions CsPbI1.8Br1.2, CsPbI2.0Br1.0, and CsPbI2.2Br0.8 exhibits a high dependence on the initial annealing step that is found to significantly affect the crystallization and texture behavior of the final perovskite film. At its optimized annealing temperature, CsPbI1.8Br1.2 exhibits a pure orthorhombic phase and only one crystal orientation of the (110) plane. Consequently, this allows for the best efficiency of up to 14.6\% and the longest operational lifetime, T-S80, of approximate to 300 h, averaged of over six solar cells, during the maximum power point tracking measurement under continuous light illumination and nitrogen atmosphere. This work provides essential progress on the enhancement of photovoltaic performance and stability of CsPbI3 - xBrx perovskite solar cells.}, language = {en} } @misc{WangSmithSkroblinetal.2020, author = {Wang, Qiong and Smith, Joel A. and Skroblin, Dieter and Steele, Julian A. and Wolff, Christian Michael and Caprioglio, Pietro and Stolterfoht, Martin and K{\"o}bler, Hans and Turren-Cruz, Silver-Hamill and Li, Meng and Gollwitzer, Christian and Neher, Dieter and Abate, Antonio}, title = {Managing phase purities and crystal orientation for high-performance and photostable cesium lead halide perovskite solar cells}, series = {Postprints der Universit{\"a}t Potsdam : Mathematisch-Naturwissenschaftliche Reihe}, journal = {Postprints der Universit{\"a}t Potsdam : Mathematisch-Naturwissenschaftliche Reihe}, number = {9}, issn = {1866-8372}, doi = {10.25932/publishup-52537}, url = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-525374}, pages = {11}, year = {2020}, abstract = {Inorganic perovskites with cesium (Cs+) as the cation have great potential as photovoltaic materials if their phase purity and stability can be addressed. Herein, a series of inorganic perovskites is studied, and it is found that the power conversion efficiency of solar cells with compositions CsPbI1.8Br1.2, CsPbI2.0Br1.0, and CsPbI2.2Br0.8 exhibits a high dependence on the initial annealing step that is found to significantly affect the crystallization and texture behavior of the final perovskite film. At its optimized annealing temperature, CsPbI1.8Br1.2 exhibits a pure orthorhombic phase and only one crystal orientation of the (110) plane. Consequently, this allows for the best efficiency of up to 14.6\% and the longest operational lifetime, T-S80, of approximate to 300 h, averaged of over six solar cells, during the maximum power point tracking measurement under continuous light illumination and nitrogen atmosphere. This work provides essential progress on the enhancement of photovoltaic performance and stability of CsPbI3 - xBrx perovskite solar cells.}, language = {en} } @article{WangZuoKimetal.2022, author = {Wang, Suhao and Zuo, Guangzheng and Kim, Jongho and Sirringhaus, Henning}, title = {Progress of Conjugated Polymers as Emerging Thermoelectric Materials}, series = {Progress in polymer science}, volume = {129}, journal = {Progress in polymer science}, publisher = {Elsevier}, address = {Oxford}, issn = {0079-6700}, doi = {10.1016/j.progpolymsci.2022.101548}, pages = {34}, year = {2022}, abstract = {Thanks to the combined effort s of scientist s in several research fields, the preceding decade has witnessed considerable progress in the use of conjugated polymers as emerging thermoelectric materials leading to significant improvements in performance and demonstration of a number of diverse applications. Despite these recent advances, systematic assessments of the impact of molecular design on thermoelectric properties are scarce. Although several reviews marginally highlight the role of chemical structure, the understanding of structure-performance relationships is still fragmented. An in-depth understanding of the relationship between molecular structure and thermoelectric properties will enable the rational design of next-generation thermoelectric polymers. To this end, this review showcases the state-of-the-art thermoelectric polymers, discusses structure-performance relationships, suggests strategies for improving thermoelectric performance that go beyond molecular design, and highlights some of the most impressive applications of thermoelectric polymers.}, language = {en} } @article{WangCherstvyChechkinetal.2020, author = {Wang, Wei and Cherstvy, Andrey G. and Chechkin, Aleksei V. and Thapa, Samudrajit and Seno, Flavio and Liu, Xianbin and Metzler, Ralf}, title = {Fractional Brownian motion with random diffusivity}, series = {Journal of physics : A, Mathematical and theoretical}, volume = {53}, journal = {Journal of physics : A, Mathematical and theoretical}, number = {47}, publisher = {IOP Publ. Ltd.}, address = {Bristol}, issn = {1751-8113}, doi = {10.1088/1751-8121/aba467}, pages = {34}, year = {2020}, abstract = {Numerous examples for a priori unexpected non-Gaussian behaviour for normal and anomalous diffusion have recently been reported in single-particle tracking experiments. Here, we address the case of non-Gaussian anomalous diffusion in terms of a random-diffusivity mechanism in the presence of power-law correlated fractional Gaussian noise. We study the ergodic properties of this model via examining the ensemble- and time-averaged mean-squared displacements as well as the ergodicity breaking parameter EB quantifying the trajectory-to-trajectory fluctuations of the latter. For long measurement times, interesting crossover behaviour is found as function of the correlation time tau characterising the diffusivity dynamics. We unveil that at short lag times the EB parameter reaches a universal plateau. The corresponding residual value of EB is shown to depend only on tau and the trajectory length. The EB parameter at long lag times, however, follows the same power-law scaling as for fractional Brownian motion. We also determine a corresponding plateau at short lag times for the discrete representation of fractional Brownian motion, absent in the continuous-time formulation. These analytical predictions are in excellent agreement with results of computer simulations of the underlying stochastic processes. Our findings can help distinguishing and categorising certain nonergodic and non-Gaussian features of particle displacements, as observed in recent single-particle tracking experiments.}, language = {en} } @article{WangCherstvyKantzetal.2021, author = {Wang, Wei and Cherstvy, Andrey G. and Kantz, Holger and Metzler, Ralf and Sokolov, Igor M.}, title = {Time averaging and emerging nonergodicity upon resetting of fractional Brownian motion and heterogeneous diffusion processes}, series = {Physical review : E, Statistical, nonlinear and soft matter physics}, volume = {104}, journal = {Physical review : E, Statistical, nonlinear and soft matter physics}, number = {2}, publisher = {American Institute of Physics}, address = {Woodbury, NY}, issn = {2470-0045}, doi = {10.1103/PhysRevE.104.024105}, pages = {27}, year = {2021}, abstract = {How different are the results of constant-rate resetting of anomalous-diffusion processes in terms of their ensemble-averaged versus time-averaged mean-squared displacements (MSDs versus TAMSDs) and how does stochastic resetting impact nonergodicity? We examine, both analytically and by simulations, the implications of resetting on the MSD- and TAMSD-based spreading dynamics of particles executing fractional Brownian motion (FBM) with a long-time memory, heterogeneous diffusion processes (HDPs) with a power-law space-dependent diffusivity D(x) = D0|x|gamma and their "combined" process of HDP-FBM. We find, inter alia, that the resetting dynamics of originally ergodic FBM for superdiffusive Hurst exponents develops disparities in scaling and magnitudes of the MSDs and mean TAMSDs indicating weak ergodicity breaking. For subdiffusive HDPs we also quantify the nonequivalence of the MSD and TAMSD and observe a new trimodal form of the probability density function. For reset FBM, HDPs and HDP-FBM we compute analytically and verify by simulations the short-time MSD and TAMSD asymptotes and long-time plateaus reminiscent of those for processes under confinement. We show that certain characteristics of these reset processes are functionally similar despite a different stochastic nature of their nonreset variants. Importantly, we discover nonmonotonicity of the ergodicitybreaking parameter EB as a function of the resetting rate r. For all reset processes studied we unveil a pronounced resetting-induced nonergodicity with a maximum of EB at intermediate r and EB similar to(1/r )-decay at large r. Alongside the emerging MSD-versus-TAMSD disparity, this r-dependence of EB can be an experimentally testable prediction. We conclude by discussing some implications to experimental systems featuring resetting dynamics.}, language = {en} } @article{WangCherstvyMetzleretal.2022, author = {Wang, Wei and Cherstvy, Andrey G. and Metzler, Ralf and Sokolov, Igor M.}, title = {Restoring ergodicity of stochastically reset anomalous-diffusion processes}, series = {Physical Review Research}, volume = {4}, journal = {Physical Review Research}, edition = {1}, publisher = {American Physical Society}, address = {College Park, Maryland, United States}, issn = {2643-1564}, doi = {10.1103/PhysRevResearch.4.013161}, pages = {013161-1 -- 013161-13}, year = {2022}, abstract = {How do different reset protocols affect ergodicity of a diffusion process in single-particle-tracking experiments? We here address the problem of resetting of an arbitrary stochastic anomalous-diffusion process (ADP) from the general mathematical points of view and assess ergodicity of such reset ADPs for an arbitrary resetting protocol. The process of stochastic resetting describes the events of the instantaneous restart of a particle's motion via randomly distributed returns to a preset initial position (or a set of those). The waiting times of such resetting events obey the Poissonian, Gamma, or more generic distributions with specified conditions regarding the existence of moments. Within these general approaches, we derive general analytical results and support them by computer simulations for the behavior of the reset mean-squared displacement (MSD), the new reset increment-MSD (iMSD), and the mean reset time-averaged MSD (TAMSD). For parental nonreset ADPs with the MSD(t)∝ tμ we find a generic behavior and a switch of the short-time growth of the reset iMSD and mean reset TAMSDs from ∝ _μ for subdiffusive to ∝ _1 for superdiffusive reset ADPs. The critical condition for a reset ADP that recovers its ergodicity is found to be more general than that for the nonequilibrium stationary state, where obviously the iMSD and the mean TAMSD are equal. The consideration of the new statistical quantifier, the iMSD—as compared to the standard MSD—restores the ergodicity of an arbitrary reset ADP in all situations when the μth moment of the waiting-time distribution of resetting events is finite. Potential applications of these new resetting results are, inter alia, in the area of biophysical and soft-matter systems.}, language = {en} } @misc{WangCherstvyMetzleretal.2022, author = {Wang, Wei and Cherstvy, Andrey G. and Metzler, Ralf and Sokolov, Igor M.}, title = {Restoring ergodicity of stochastically reset anomalous-diffusion processes}, series = {Zweitver{\"o}ffentlichungen der Universit{\"a}t Potsdam : Mathematisch-Naturwissenschaftliche Reihe}, journal = {Zweitver{\"o}ffentlichungen der Universit{\"a}t Potsdam : Mathematisch-Naturwissenschaftliche Reihe}, publisher = {Universit{\"a}tsverlag Potsdam}, address = {Potsdam}, issn = {1866-8372}, doi = {10.25932/publishup-56037}, url = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-560377}, pages = {013161-1 -- 013161-13}, year = {2022}, abstract = {How do different reset protocols affect ergodicity of a diffusion process in single-particle-tracking experiments? We here address the problem of resetting of an arbitrary stochastic anomalous-diffusion process (ADP) from the general mathematical points of view and assess ergodicity of such reset ADPs for an arbitrary resetting protocol. The process of stochastic resetting describes the events of the instantaneous restart of a particle's motion via randomly distributed returns to a preset initial position (or a set of those). The waiting times of such resetting events obey the Poissonian, Gamma, or more generic distributions with specified conditions regarding the existence of moments. Within these general approaches, we derive general analytical results and support them by computer simulations for the behavior of the reset mean-squared displacement (MSD), the new reset increment-MSD (iMSD), and the mean reset time-averaged MSD (TAMSD). For parental nonreset ADPs with the MSD(t)∝ tμ we find a generic behavior and a switch of the short-time growth of the reset iMSD and mean reset TAMSDs from ∝ _μ for subdiffusive to ∝ _1 for superdiffusive reset ADPs. The critical condition for a reset ADP that recovers its ergodicity is found to be more general than that for the nonequilibrium stationary state, where obviously the iMSD and the mean TAMSD are equal. The consideration of the new statistical quantifier, the iMSD—as compared to the standard MSD—restores the ergodicity of an arbitrary reset ADP in all situations when the μth moment of the waiting-time distribution of resetting events is finite. Potential applications of these new resetting results are, inter alia, in the area of biophysical and soft-matter systems.}, language = {en} } @article{WangMetzlerCherstvy2022, author = {Wang, Wei and Metzler, Ralf and Cherstvy, Andrey G.}, title = {Anomalous diffusion, aging, and nonergodicity of scaled Brownian motion with fractional Gaussian noise: overview of related experimental observations and models}, series = {Physical chemistry, chemical physics : PCCP ; a journal of European chemical societies}, volume = {24}, journal = {Physical chemistry, chemical physics : PCCP ; a journal of European chemical societies}, number = {31}, publisher = {RSC Publ.}, address = {Cambridge}, issn = {1463-9076}, doi = {10.1039/d2cp01741e}, pages = {18482 -- 18504}, year = {2022}, abstract = {How does a systematic time-dependence of the diffusion coefficient D(t) affect the ergodic and statistical characteristics of fractional Brownian motion (FBM)? Here, we answer this question via studying the characteristics of a set of standard statistical quantifiers relevant to single-particle-tracking (SPT) experiments. We examine, for instance, how the behavior of the ensemble- and time-averaged mean-squared displacements-denoted as the standard MSD < x(2)(Delta)> and TAMSD <<(delta(2)(Delta))over bar>> quantifiers-of FBM featuring < x(2) (Delta >> = <<(delta(2)(Delta >)over bar>> proportional to Delta(2H) (where H is the Hurst exponent and Delta is the [lag] time) changes in the presence of a power-law deterministically varying diffusivity D-proportional to(t) proportional to t(alpha-1) -germane to the process of scaled Brownian motion (SBM)-determining the strength of fractional Gaussian noise. The resulting compound "scaled-fractional" Brownian motion or FBM-SBM is found to be nonergodic, with < x(2)(Delta >> proportional to Delta(alpha+)(2H)(-1) and <(delta 2(Delta >) over bar > proportional to Delta(2H). We also detect a stalling behavior of the MSDs for very subdiffusive SBM and FBM, when alpha + 2H - 1 < 0. The distribution of particle displacements for FBM-SBM remains Gaussian, as that for the parent processes of FBM and SBM, in the entire region of scaling exponents (0 < alpha < 2 and 0 < H < 1). The FBM-SBM process is aging in a manner similar to SBM. The velocity autocorrelation function (ACF) of particle increments of FBM-SBM exhibits a dip when the parent FBM process is subdiffusive. Both for sub- and superdiffusive FBM contributions to the FBM-SBM process, the SBM exponent affects the long-time decay exponent of the ACF. Applications of the FBM-SBM-amalgamated process to the analysis of SPT data are discussed. A comparative tabulated overview of recent experimental (mainly SPT) and computational datasets amenable for interpretation in terms of FBM-, SBM-, and FBM-SBM-like models of diffusion culminates the presentation. The statistical aspects of the dynamics of a wide range of biological systems is compared in the table, from nanosized beads in living cells, to chromosomal loci, to water diffusion in the brain, and, finally, to patterns of animal movements.}, language = {en} } @article{WangSenoSokolovetal.2020, author = {Wang, Wei and Seno, Flavio and Sokolov, Igor M. and Chechkin, Aleksei V. and Metzler, Ralf}, title = {Unexpected crossovers in correlated random-diffusivity processes}, series = {New Journal of Physics}, volume = {22}, journal = {New Journal of Physics}, publisher = {Dt. Physikalische Ges.}, address = {Bad Honnef}, issn = {1367-2630}, doi = {10.1088/1367-2630/aba390}, pages = {17}, year = {2020}, abstract = {The passive and active motion of micron-sized tracer particles in crowded liquids and inside living biological cells is ubiquitously characterised by 'viscoelastic' anomalous diffusion, in which the increments of the motion feature long-ranged negative and positive correlations. While viscoelastic anomalous diffusion is typically modelled by a Gaussian process with correlated increments, so-called fractional Gaussian noise, an increasing number of systems are reported, in which viscoelastic anomalous diffusion is paired with non-Gaussian displacement distributions. Following recent advances in Brownian yet non-Gaussian diffusion we here introduce and discuss several possible versions of random-diffusivity models with long-ranged correlations. While all these models show a crossover from non-Gaussian to Gaussian distributions beyond some correlation time, their mean squared displacements exhibit strikingly different behaviours: depending on the model crossovers from anomalous to normal diffusion are observed, as well as a priori unexpected dependencies of the effective diffusion coefficient on the correlation exponent. Our observations of the non-universality of random-diffusivity viscoelastic anomalous diffusion are important for the analysis of experiments and a better understanding of the physical origins of 'viscoelastic yet non-Gaussian' diffusion.}, language = {en} } @misc{WangSenoSokolovetal.2020, author = {Wang, Wei and Seno, Flavio and Sokolov, Igor M. and Chechkin, Aleksei V. and Metzler, Ralf}, title = {Unexpected crossovers in correlated random-diffusivity processes}, number = {1006}, issn = {1866-8372}, doi = {10.25932/publishup-48004}, url = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-480049}, pages = {18}, year = {2020}, abstract = {The passive and active motion of micron-sized tracer particles in crowded liquids and inside living biological cells is ubiquitously characterised by 'viscoelastic' anomalous diffusion, in which the increments of the motion feature long-ranged negative and positive correlations. While viscoelastic anomalous diffusion is typically modelled by a Gaussian process with correlated increments, so-called fractional Gaussian noise, an increasing number of systems are reported, in which viscoelastic anomalous diffusion is paired with non-Gaussian displacement distributions. Following recent advances in Brownian yet non-Gaussian diffusion we here introduce and discuss several possible versions of random-diffusivity models with long-ranged correlations. While all these models show a crossover from non-Gaussian to Gaussian distributions beyond some correlation time, their mean squared displacements exhibit strikingly different behaviours: depending on the model crossovers from anomalous to normal diffusion are observed, as well as a priori unexpected dependencies of the effective diffusion coefficient on the correlation exponent. Our observations of the non-universality of random-diffusivity viscoelastic anomalous diffusion are important for the analysis of experiments and a better understanding of the physical origins of 'viscoelastic yet non-Gaussian' diffusion.}, language = {en} } @inproceedings{WangBreternitzSchorr2021, author = {Wang, Zhenyu and Breternitz, Joachim and Schorr, Susan}, title = {Cation disorder in zinc-group IV- nitride and oxide nitride semiconductor materials revealed through neutron diffraction}, series = {Acta crystallographica / International Union of Crystallography. Section A, Foundations and advances}, volume = {77}, booktitle = {Acta crystallographica / International Union of Crystallography. Section A, Foundations and advances}, number = {Suppl.}, publisher = {Blackwell}, address = {Oxford [u.a.]}, issn = {2053-2733}, doi = {10.1107/S0108767321086256}, pages = {C1077 -- C1077}, year = {2021}, language = {en} } @article{WarbyZuZeiskeetal.2022, author = {Warby, Jonathan and Zu, Fengshuo and Zeiske, Stefan and Gutierrez-Partida, Emilio and Frohloff, Lennart and Kahmann, Simon and Frohna, Kyle and Mosconi, Edoardo and Radicchi, Eros and Lang, Felix and Shah, Sahil and Pena-Camargo, Francisco and Hempel, Hannes and Unold, Thomas and Koch, Norbert and Armin, Ardalan and De Angelis, Filippo and Stranks, Samuel D. and Neher, Dieter and Stolterfoht, Martin}, title = {Understanding performance limiting interfacial recombination in pin Perovskite solar cells}, series = {Advanced energy materials}, volume = {12}, journal = {Advanced energy materials}, number = {12}, publisher = {Wiley-VCH}, address = {Weinheim}, issn = {1614-6832}, doi = {10.1002/aenm.202103567}, pages = {10}, year = {2022}, abstract = {Perovskite semiconductors are an attractive option to overcome the limitations of established silicon based photovoltaic (PV) technologies due to their exceptional opto-electronic properties and their successful integration into multijunction cells. However, the performance of single- and multijunction cells is largely limited by significant nonradiative recombination at the perovskite/organic electron transport layer junctions. In this work, the cause of interfacial recombination at the perovskite/C-60 interface is revealed via a combination of photoluminescence, photoelectron spectroscopy, and first-principle numerical simulations. It is found that the most significant contribution to the total C-60-induced recombination loss occurs within the first monolayer of C-60, rather than in the bulk of C-60 or at the perovskite surface. The experiments show that the C-60 molecules act as deep trap states when in direct contact with the perovskite. It is further demonstrated that by reducing the surface coverage of C-60, the radiative efficiency of the bare perovskite layer can be retained. The findings of this work pave the way toward overcoming one of the most critical remaining performance losses in perovskite solar cells.}, language = {en} } @article{WarrenEllisonBarkovetal.2017, author = {Warren, Donald C. and Ellison, Donald C. and Barkov, Maxim V. and Nagataki, Shigehiro}, title = {Nonlinear Particle Acceleration and Thermal Particles in GRB Afterglows}, series = {The astrophysical journal : an international review of spectroscopy and astronomical physics}, volume = {835}, journal = {The astrophysical journal : an international review of spectroscopy and astronomical physics}, number = {2}, publisher = {IOP Publ. Ltd.}, address = {Bristol}, issn = {0004-637X}, doi = {10.3847/1538-4357/aa56c3}, pages = {15}, year = {2017}, abstract = {The standard model for GRB afterglow emission treats the accelerated electron population as a simple power law, N(E) proportional to E-p for p greater than or similar to 2. However, in standard Fermi shock acceleration, a substantial fraction of the swept-up particles do not enter the acceleration process at all. Additionally, if acceleration is efficient, then the nonlinear back-reaction of accelerated particles on the shock structure modifies the shape of the nonthermal tail of the particle spectra. Both of these modifications to the standard synchrotron afterglow impact the luminosity, spectra, and temporal variation of the afterglow. To examine the effects of including thermal particles and nonlinear particle acceleration on afterglow emission, we follow a hydrodynamical model for an afterglow jet and simulate acceleration at numerous points during the evolution. When thermal particles are included, we find that the electron population is at no time well fitted by a single power law, though the highest-energy electrons are; if the acceleration is efficient, then the power-law region is even smaller. Our model predicts hard-soft-hard spectral evolution at X-ray energies, as well as an uncoupled X-ray and optical light curve. Additionally, we show that including emission from thermal particles has drastic effects (increases by factors of 100 and 30, respectively) on the observed flux at optical and GeV energies. This enhancement of GeV emission makes afterglow detections by future gamma-ray observatories, such as CTA, very likely.}, language = {en} } @phdthesis{Washuettl2004, author = {Wash{\"u}ttl, Albert}, title = {EI Eridani and the art of doppler imaging : a long-term study}, url = {http://nbn-resolving.de/urn:nbn:de:kobv:517-0001714}, school = {Universit{\"a}t Potsdam}, year = {2004}, abstract = {Das Verst{\"a}ndnis magnetisch verursachter Aktivit{\"a}t auf Sternen sowie der zugrundeliegenden Dynamoprozesse ist von fundamentaler Bedeutung f{\"u}r das Verst{\"a}ndnis von Entstehung und Entwicklung von Sternen sowie des Lebens im Universum. Sichtbare Erscheinungen dieser stellaren Aktivit{\"a}t sind u.a. Sternflecken, welche als Indikatoren des zugrundeliegenden Magnetfeldes dienen. Solche Flecken k{\"o}nnen auf anderen Sternen als der Sonne nicht direkt beobachtet werden, zumal mit den heutigen technischen Mitteln eine Aufl{\"o}sung der Oberfl{\"a}che selbst der benachbarten Sterne unm{\"o}glich ist. Eine indirekte Rekonstruktionsmethode namens 'Doppler Imaging' erlaubt es jedoch, auf die Temperaturverteilung auf der Sternoberfl{\"a}che zu schließen. F{\"u}r diese Arbeit wurden elf Jahre kontinuierlicher spektroskopischer Beobachtungen des aktiven Doppelsterns EI Eridani herangezogen, um insgesamt 34 Dopplerkarten zu erstellen. In der Folge wird versucht, eine Grundlage zu schaffen f{\"u}r die Analyse des zweidimensionalen Informationsgehalts dieser Karten. Drei Oberfl{\"a}chenkartenparameter werden vorgeschlagen: gemittelte Temperatur, getrennt f{\"u}r verschiedenen stellare Breitenb{\"a}nder; relative Fleckenh{\"a}ufigkeit; und, zum Zwecke der Auswertung der strukturellen Temperaturverteilung, L{\"a}ngen- und Breiten-Ortsfunktion der Sternfleckenh{\"a}ufung. Die resultierenden Werte zeigen deutlich, daß kein zeitlicher Zusammenhang mit dem photometrischen Aktivit{\"a}tszyklus besteht. Die Morphologie der Fleckenverteilung bleibt w{\"a}hrend des kompletten Beobachtungszeitraums im wesentlichen konstant. Im Gegensatz zur Sonne gibt es also, im beobachteten Zeitraum und innerhalb der bestehenden Genauigkeit, keinen Fleckenzyklus auf dem aktiven Stern EI Eri. Dar{\"u}berhinaus wurde eine ausf{\"u}hrliche Studie der stellaren Parameter von EI Eri und eine vorl{\"a}ufige Absch{\"a}tzung der differentiellen Rotation auf EI Eri durchgef{\"u}hrt, die eine anti-solare Ausrichtung aufzuweisen scheint, d.h. der Pol rotiert schneller als der {\"A}quator.}, language = {en} }