@misc{YangGuehrVecchioneetal.2016,
  author    = {Yang, Jie and Guehr, Markus and Vecchione, Theodore and Robinson, Matthew Scott and Li, Renkai and Hartmann, Nick and Shen, Xiaozhe and Coffee, Ryan and Corbett, Jeff and Fry, Alan and Gaffney, Kelly and Gorkhover, Tais and Hast, Carsten and Jobe, Keith and Makasyuk, Igor and Reid, Alexander and Robinson, Joseph and Vetter, Sharon and Wang, Fenglin and Weathersby, Stephen and Yoneda, Charles and Wang, Xijie and Centurion, Martin},
  title     = {Femtosecond gas phase electron diffraction with MeV electrons},
  url       = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-394989},
  pages     = {19},
  year      = {2016},
  abstract  = {We present results on ultrafast gas electron diffraction (UGED) experiments with femtosecond resolution using the MeV electron gun at SLAC National Accelerator Laboratory. UGED is a promising method to investigate molecular dynamics in the gas phase because electron pulses can probe the structure with a high spatial resolution. Until recently, however, it was not possible for UGED to reach the relevant timescale for the motion of the nuclei during a molecular reaction. Using MeV electron pulses has allowed us to overcome the main challenges in reaching femtosecond resolution, namely delivering short electron pulses on a gas target, overcoming the effect of velocity mismatch between pump laser pulses and the probe electron pulses, and maintaining a low timing jitter. At electron kinetic energies above 3 MeV, the velocity mismatch between laser and electron pulses becomes negligible. The relativistic electrons are also less susceptible to temporal broadening due to the Coulomb force. One of the challenges of diffraction with relativistic electrons is that the small de Broglie wavelength results in very small diffraction angles. In this paper we describe the new setup and its characterization, including capturing static diffraction patterns of molecules in the gas phase, finding time-zero with sub-picosecond accuracy and first time-resolved diffraction experiments. The new device can achieve a temporal resolution of 100 fs root-mean-square, and sub-angstrom spatial resolution. The collimation of the beam is sufficient to measure the diffraction pattern, and the transverse coherence is on the order of 2 nm. Currently, the temporal resolution is limited both by the pulse duration of the electron pulse on target and by the timing jitter, while the spatial resolution is limited by the average electron beam current and the signal-to-noise ratio of the detection system. We also discuss plans for improving both the temporal resolution and the spatial resolution.},
  language  = {en}
}
@misc{TomovPenaRoqueetal.2016,
  author    = {Tomov, Petar and Pena, Rodrigo F. O. and Roque, Antonio C. and Zaks, Michael A.},
  title     = {Mechanisms of self-sustained oscillatory states in hierarchical modular networks with mixtures of electrophysiological cell types},
  series = {Frontiers in computational neuroscience},
  journal   = {Frontiers in computational neuroscience},
  url       = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-407724},
  pages     = {17},
  year      = {2016},
  abstract  = {In a network with a mixture of different electrophysiological types of neurons linked by excitatory and inhibitory connections, temporal evolution leads through repeated epochs of intensive global activity separated by intervals with low activity level. This behavior mimics "up" and "down" states, experimentally observed in cortical tissues in absence of external stimuli. We interpret global dynamical features in terms of individual dynamics of the neurons. In particular, we observe that the crucial role both in interruption and in resumption of global activity is played by distributions of the membrane recovery variable within the network. We also demonstrate that the behavior of neurons is more influenced by their presynaptic environment in the network than by their formal types, assigned in accordance with their response to constant current.},
  language  = {en}
}
@phdthesis{Schulz2016,
  author    = {Schulz, Alexander},
  title     = {Untersuchung der Wechselwirkung synoptisch-skaliger mit orographisch bedingten Prozessen in der arktischen Grenzschicht {\"u}ber Spitzbergen},
  url       = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-400058},
  school      = {Universit{\"a}t Potsdam},
  pages     = {vi, 194},
  year      = {2016},
  abstract  = {In der vorliegenden Arbeit wird die planetare Grenzschicht in Ny-{\AA}lesund, Spitzbergen, sowohl bez{\"u}glich kleinskaliger („mikrometeorologischer") Effekte als auch in ihrer Kopplung mit der Synoptik untersucht. Dazu werden verschiedene Beobachtungsdaten aus der S{\"a}ule und in Bodenn{\"a}he zusammengezogen und bewertet. Die so gewonnenen Datens{\"a}tze werden dann zur Validierung eines nicht-hydrostatischen, regionalen Klimamodells genutzt. Weiterhin werden orographisch bedingte Einfl{\"u}sse, die Untergrundbeschaffenheit und die lokale Heterogenit{\"a}t der Unterlage untersucht. Hierzu werden meteorologische Gr{\"o}ßen, wie die Variabilit{\"a}t der Temperatur und insbesondere die j{\"a}hrliche Windverteilung in Bodenn{\"a}he untersucht und es erfolgt ein Vergleich von in-situ gemessenen turbulenten Fl{\"u}ssen von den Eddy-Kovarianz-Messkomplexen bei Ny-{\AA}lesund und im Bayelva-Tal unter demselben Aspekt. Es zeigt sich, dass der Eddy-Kovarianz-Messkomplex im Bayelva-Tal sehr stark durch eine orographisch bedingte Kanalisierung der Str{\"o}mung beeinflusst ist und sich nicht f{\"u}r Vergleiche mit regionalen Klimamodellen mit horizontalen Aufl{\"o}sungen von <1km eignet. Die hohe Bodenfeuchte im Bayelva-Tal f{\"u}hrt zudem zu einem deutlich kleineren Bowen-Verh{\"a}ltnis, als es f{\"u}r diese Region zu erwarten ist. Der Eddy-Kovarianz-Messkomplex bei Ny-{\AA}lesund erweist sich hingegen als geeigneter f{\"u}r solche Modellvergleiche, aufgrund der typischen, k{\"u}stennahen Windverteilung und des repr{\"a}sentativen Footprints. Letzteres wird durch die Bestimmung der Footprint-Klimatologie des Jahres 2013 mit einem aktuellen Footprint-Modell erarbeitet. Weiterhin wird die Auswirkung von (Anti-) Zyklonen {\"u}ber den Archipel auf die zeitliche Variabilit{\"a}t der lokalen Grenzschichteigenschaften untersucht und bewertet. Dazu wird ein Zyklonen-Detektions-Algorithmus auf ERA-Interim-Reanalysedatens{\"a}tze angewendet, wodurch die H{\"a}ufigkeit von nahezu ideal konzentrischen Hoch- und die Tiefdruckgebieten f{\"u}r drei Jahre bestimmt wird. Aus dieser Verteilung werden insgesamt drei interessante Zeitr{\"a}ume zu verschiedenen Jahreszeiten ausgew{\"a}hlt und im Rahmen von Prozessstudien die lokalen bodennahen meteorologischen Messungen, der turbulente Austausch an der Oberfl{\"a}che und die Grenzschichtdynamik in der S{\"a}ule untersucht. Die zeitliche Variabilit{\"a}t der dynamischen Grenzschichtstabilit{\"a}t in der S{\"a}ule wird anhand von zeitlich hoch aufgel{\"o}sten vertikalen Profilen der Bulk-Richardson-Zahl aus Kompositprofilen aus Fernerkundungsinstrumenten (Radiometer, Wind-LIDAR) sowie Mastdaten (BSRN-Mast) untersucht und die Grenzschichth{\"o}he ermittelt. Aus diesen Analysen ergibt sich eine deutliche Abh{\"a}ngigkeit der thermischen Stabilit{\"a}t beim Durchzug von Fronten, eine damit einhergehende erhebliche Abh{\"a}ngigkeit der Grenzschichtdynamik und der Grenzschichth{\"o}he sowie des turbulenten Austauschs von der zeitlichen Variabilit{\"a}t der Windgeschwindigkeit in der S{\"a}ule. Auf Grundlage der Standortanalysen und Prozessstudien erfolgt ein Vergleich der bodennahen Messungen und den Beobachtungen aus der S{\"a}ule, sowohl von den genannten Fernerkundungsinstrumenten als auch von In-situ-Messungen (Radiosonden) f{\"u}r den Zeitraum einer Radiosondierungskampagne mit dem nicht-hydrostatischen, regionalen Klimamodel WRF (ARW). Auf Grundlage der Fragestellung, inwieweit aktuelle Schemata die Grenzschichtcharakteristika in orographisch stark gegliedertem Gel{\"a}nde in der Arktis reproduzieren k{\"o}nnen, werden zwei Grenzschichtparametrisierungsschemata mit verschiedenen Ordnungen der Schließung validiert. Hierzu wird die zeitliche Variabilit{\"a}t der Temperatur, der Feuchte und des Windfeldes in der S{\"a}ule bis 2000m in den Simulationen mit den Beobachtungsdaten vergleichen. Es wird gezeigt, dass durch Modifikation der Initialwertfelder eine sehr gute {\"U}bereinstimmung zwischen den Simulationen und den Beobachtungen bereits bei einer horizontalen Aufl{\"o}sung von 1km erreicht werden kann und die Wahl des Grenzschichtschemas nur untergeordneten Einfluss hat. Hieraus werden Ans{\"a}tze der Weiterentwicklung der Parametrisierungen, aber auch Empfehlungen bez{\"u}glich der Initialwertfelder, wie der Landmaske und der Orographie, vorgeschlagen.},
  language  = {de}
}
@phdthesis{Schroeder2016,
  author    = {Schr{\"o}der, Henning},
  title     = {Ultrafast electron dynamics in Fe(CO)5 and Cr(CO)6},
  url       = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-94589},
  school      = {Universit{\"a}t Potsdam},
  pages     = {v, 87},
  year      = {2016},
  abstract  = {In this thesis, the two prototype catalysts Fe(CO)₅ and Cr(CO)₆ are investigated with time-resolved photoelectron spectroscopy at a high harmonic setup. In both of these metal carbonyls, a UV photon can induce the dissociation of one or more ligands of the complex. The mechanism of the dissociation has been debated over the last decades. The electronic dynamics of the first dissociation occur on the femtosecond timescale. For the experiment, an existing high harmonic setup was moved to a new location, was extended, and characterized. The modified setup can induce dynamics in gas phase samples with photon energies of 1.55eV, 3.10eV, and 4.65eV. The valence electronic structure of the samples can be probed with photon energies between 20eV and 40eV. The temporal resolution is 111fs to 262fs, depending on the combination of the two photon energies. The electronically excited intermediates of the two complexes, as well as of the reaction product Fe(CO)₄, could be observed with photoelectron spectroscopy in the gas phase for the first time. However, photoelectron spectroscopy gives access only to the final ionic states. Corresponding calculations to simulate these spectra are still in development. The peak energies and their evolution in time with respect to the initiation pump pulse have been determined, these peaks have been assigned based on literature data. The spectra of the two complexes show clear differences. The dynamics have been interpreted with the assumption that the motion of peaks in the spectra relates to the movement of the wave packet in the multidimensional energy landscape. The results largely confirm existing models for the reaction pathways. In both metal carbonyls, this pathway involves a direct excitation of the wave packet to a metal-to-ligand charge transfer state and the subsequent crossing to a dissociative ligand field state. The coupling of the electronic dynamics to the nuclear dynamics could explain the slower dissociation in Fe(CO)₅ as compared to Cr(CO)₆.},
  language  = {en}
}
@misc{SchickEckertPontiusetal.2016,
  author    = {Schick, Daniel and Eckert, Sebastian and Pontius, Niko and Mitzner, Rolf and F{\"o}hlisch, Alexander and Holldack, Karsten and Sorgenfrei, Nomi},
  title     = {Versatile soft X-ray-optical cross-correlator for ultrafast applications},
  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    = {1331},
  issn      = {1866-8372},
  doi       = {10.25932/publishup-43696},
  url       = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-436962},
  pages     = {054304-1 -- 054304-8},
  year      = {2016},
  abstract  = {We present an X-ray-optical cross-correlator for the soft (> 150 eV) up to the hard X-ray regime based on a molybdenum-silicon superlattice. The cross-correlation is done by probing intensity and position changes of superlattice Bragg peaks caused by photoexcitation of coherent phonons. This approach is applicable for a wide range of X-ray photon energies as well as for a broad range of excitation wavelengths and requires no external fields or changes of temperature. Moreover, the cross-correlator can be employed on a 10 ps or 100 fs time scale featuring up to 50\% total X-ray reflectivity and transient signal changes of more than 20\%. (C) 2016 Author(s).},
  language  = {en}
}
@misc{RaetzelWilkensMenzel2016,
  author    = {R{\"a}tzel, Dennis and Wilkens, Martin and Menzel, Ralf},
  title     = {Gravitational properties of light},
  url       = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-90553},
  year      = {2016},
  abstract  = {The gravitational field of a laser pulse of finite lifetime, is investigated in the framework of linearized gravity. Although the effects are very small, they may be of fundamental physical interest. It is shown that the gravitational field of a linearly polarized light pulse is modulated as the norm of the corresponding electric field strength, while no modulations arise for circular polarization. In general, the gravitational field is independent of the polarization direction. It is shown that all physical effects are confined to spherical shells expanding with the speed of light, and that these shells are imprints of the spacetime events representing emission and absorption of the pulse. Nearby test particles at rest are attracted towards the pulse trajectory by the gravitational field due to the emission of the pulse, and they are repelled from the pulse trajectory by the gravitational field due to its absorption. Examples are given for the size of the attractive effect. It is recovered that massless test particles do not experience any physical effect if they are co-propagating with the pulse, and that the acceleration of massless test particles counter-propagating with respect to the pulse is four times stronger than for massive particles at rest. The similarities between the gravitational effect of a laser pulse and Newtonian gravity in two dimensions are pointed out. The spacetime curvature close to the pulse is compared to that induced by gravitational waves from astronomical sources.},
  language  = {en}
}
@misc{ReppertPuddellKocetal.2016,
  author    = {Reppert, Alexander von and Puddell, J. and Koc, A. and Reinhardt, M. and Leitenberger, Wolfram and Dumesnil, K. and Zamponi, Flavio and Bargheer, Matias},
  title     = {Persistent nonequilibrium dynamics of the thermal energies in the spin and phonon systems of an antiferromagnet},
  url       = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-98710},
  pages     = {11},
  year      = {2016},
  abstract  = {We present a temperature and fluence dependent Ultrafast X-Ray Diffraction study of a laser-heated antiferromagnetic dysprosium thin film. The loss of antiferromagnetic order is evidenced by a pronounced lattice contraction. We devise a method to determine the energy flow between the phonon and spin system from calibrated Bragg peak positions in thermal equilibrium. Reestablishing the magnetic order is much slower than the cooling of the lattice, especially around the N{\´e}el temperature. Despite the pronounced magnetostriction, the transfer of energy from the spin system to the phonons in Dy is slow after the spin-order is lost.},
  language  = {en}
}
@misc{PimenovaGoldobinRosenblumetal.2016,
  author    = {Pimenova, Anastasiya V. and Goldobin, Denis S. and Rosenblum, Michael and Pikovskij, Arkadij},
  title     = {Interplay of coupling and common noise at the transition to synchrony in oscillator populations},
  url       = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-103471},
  pages     = {7},
  year      = {2016},
  abstract  = {There are two ways to synchronize oscillators: by coupling and by common forcing, which can be pure noise. By virtue of the Ott-Antonsen ansatz for sine-coupled phase oscillators, we obtain analytically tractable equations for the case where both coupling and common noise are present. While noise always tends to synchronize the phase oscillators, the repulsive coupling can act against synchrony, and we focus on this nontrivial situation. For identical oscillators, the fully synchronous state remains stable for small repulsive coupling; moreover it is an absorbing state which always wins over the asynchronous regime. For oscillators with a distribution of natural frequencies, we report on a counter-intuitive effect of dispersion (instead of usual convergence) of the oscillators frequencies at synchrony; the latter effect disappears if noise vanishes.},
  language  = {en}
}
@misc{PavlenkoSanderMitzscherlingetal.2016,
  author    = {Pavlenko, Elena S. and Sander, Mathias and Mitzscherling, Steffen and Pudell, Jan-Etienne and Zamponi, Flavio and R{\"o}ssle, Matthias and Bojahr, Andre and Bargheer, Matias},
  title     = {Azobenzene - functionalized polyelectrolyte nanolayers as ultrafast optoacoustic transducers},
  volume    = {8},
  doi       = {10.1039/C6NR01448H},
  url       = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-101996},
  pages     = {13297 -- 13302},
  year      = {2016},
  abstract  = {We introduce azobenzene-functionalized polyelectrolyte multilayers as efficient, inexpensive optoacoustic transducers for hyper-sound strain waves in the GHz range. By picosecond transient reflectivity measurements we study the creation of nanoscale strain waves, their reflection from interfaces, damping by scattering from nanoparticles and propagation in soft and hard adjacent materials like polymer layers, quartz and mica. The amplitude of the generated strain ε ∼ 5 × 10-4 is calibrated by ultrafast X-ray diffraction.},
  language  = {en}
}
@phdthesis{Pavlenko2016,
  author    = {Pavlenko, Elena},
  title     = {Hybrid nanolayer architectures for ultrafast acousto-plasmonics in soft matter},
  url       = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-99544},
  school      = {Universit{\"a}t Potsdam},
  pages     = {85},
  year      = {2016},
  abstract  = {The goal of the presented work is to explore the interaction between gold nanorods (GNRs) and hyper-sound waves. For the generation of the hyper-sound I have used Azobenzene-containing polymer transducers. Multilayer polymer structures with well-defined thicknesses and smooth interfaces were built via layer-by-layer deposition. Anionic polyelectrolytes with Azobenzene side groups (PAzo) were alternated with cationic polymer PAH, for the creation of transducer films. PSS/PAH multilayer were built for spacer layers, which do not absorb in the visible light range. The properties of the PAzo/PAH film as a transducer are carefully characterized by static and transient optical spectroscopy. The optical and mechanical properties of the transducer are studied on the picosecond time scale. In particular the relative change of the refractive index of the photo-excited and expanded PAH/PAzo is Δn/n = - 2.6*10-4. Calibration of the generated strain is performed by ultrafast X-ray diffraction calibrated the strain in a Mica substrate, into which the hyper-sound is transduced. By simulating the X-ray data with a linear-chain-model the strain in the transducer under the excitation is derived to be Δd/d ~ 5*10-4. Additional to the investigation of the properties of the transducer itself, I have performed a series of experiments to study the penetration of the generated strain into various adjacent materials. By depositing the PAzo/PAH film onto a PAH/PSS structure with gold nanorods incorporated in it, I have shown that nanoscale impurities can be detected via the scattering of hyper-sound. Prior to the investigation of complex structures containing GNRs and the transducer, I have performed several sets of experiments on GNRs deposited on a small buffer of PSS/PAH. The static and transient response of GNRs is investigated for different fluence of the pump beam and for different dielectric environments (GNRs covered by PSS/PAH). A systematic analysis of sample architectures is performed in order to construct a sample with the desired effect of GNRs responding to the hyper-sound strain wave. The observed shift of a feature related to the longitudinal plasmon resonance in the transient reflection spectra is interpreted as the event of GNRs sensing the strain wave. We argue that the shift of the longitudinal plasmon resonance is caused by the viscoelastic deformation of the polymer around the nanoparticle. The deformation is induced by the out of plane difference in strain in the area directly under a particle and next to it. Simulations based on the linear chain model support this assumption. Experimentally this assumption is proven by investigating the same structure, with GNRs embedded in a PSS/PAH polymer layer. The response of GNRs to the hyper-sound wave is also observed for the sample structure with GNRs embedded in PAzo/PAH films. The response of GNRs in this case is explained to be driven by the change of the refractive index of PAzo during the strain propagation.},
  language  = {en}
}
@misc{NiskanenKooserKoskeloetal.2016,
  author    = {Niskanen, Johannes and Kooser, Kuno and Koskelo, Jaakko and K{\"a}{\"a}mbre, Tanel and Kunnus, Kristjan and Pietzsch, Annette and Quevedo, Wilson and Hakala, Mikko and F{\"o}hlisch, Alexander and Huotari, Simo and Kukk, Edwin},
  title     = {Density functional simulation of resonant inelastic X-ray scattering experiments in liquids: acetonitrile},
  url       = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-395133},
  pages     = {7},
  year      = {2016},
  abstract  = {In this paper we report an experimental and computational study of liquid acetonitrile (H3C-C[triple bond, length as m-dash]N) by resonant inelastic X-ray scattering (RIXS) at the N K-edge. The experimental spectra exhibit clear signatures of the electronic structure of the valence states at the N site and incident-beam-polarization dependence is observed as well. Moreover, we find fine structure in the quasielastic line that is assigned to finite scattering duration and nuclear relaxation. We present a simple and light-to-evaluate model for the RIXS maps and analyze the experimental data using this model combined with ab initio molecular dynamics simulations. In addition to polarization-dependence and scattering-duration effects, we pinpoint the effects of different types of chemical bonding to the RIXS spectrum and conclude that the H2C-C[double bond, length as m-dash]NH isomer, suggested in the literature, does not exist in detectable quantities. We study solution effects on the scattering spectra with simulations in liquid and in vacuum. The presented model for RIXS proved to be light enough to allow phase-space-sampling and still accurate enough for identification of transition lines in physical chemistry research by RIXS.},
  language  = {en}
}
@misc{NishikawaMizunoNiemiecetal.2016,
  author    = {Nishikawa, Ken-Ichi and Mizuno, Yosuke and Niemiec, Jacek and Kobzar, Oleh and Pohl, Martin and G{\´o}mez, Jose L. and Duţan, Ioana and Pe'er, Asaf and Frederiksen, Jacob Trier and Nordlund, {\AA}ke and Meli, Athina and Sol, Helene and Hardee, Philip E. and Hartmann, Dieter H.},
  title     = {Microscopic processes in global relativistic jets containing helical magnetic fields},
  series = {Galaxies},
  journal   = {Galaxies},
  url       = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-407604},
  pages     = {9},
  year      = {2016},
  abstract  = {In the study of relativistic jets one of the key open questions is their interaction with the environment on the microscopic level. Here, we study the initial evolution of both electron-proton (e(-)-p(+)) and electron-positron (e(+/-)) relativistic jets containing helical magnetic fields, focusing on their interaction with an ambient plasma. We have performed simulations of "global" jets containing helical magnetic fields in order to examine how helical magnetic fields affect kinetic instabilities such as the Weibel instability, the kinetic Kelvin-Helmholtz instability (kKHI) and the Mushroom instability (MI). In our initial simulation study these kinetic instabilities are suppressed and new types of instabilities can grow. In the e(-)-p(+) jet simulation a recollimation-like instability occurs and jet electrons are strongly perturbed. In the e(+/-) jet simulation a recollimation-like instability occurs at early times followed by a kinetic instability and the general structure is similar to a simulation without helical magnetic field. Simulations using much larger systems are required in order to thoroughly follow the evolution of global jets containing helical magnetic fields.},
  language  = {en}
}
@misc{NeherKniepertElimelechetal.2016,
  author    = {Neher, Dieter and Kniepert, Juliane and Elimelech, Arik and Koster, L. Jan Anton},
  title     = {A New Figure of Merit for Organic Solar Cells with Transport-limited Photocurrents},
  url       = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-91414},
  pages     = {9},
  year      = {2016},
  abstract  = {Compared to their inorganic counterparts, organic semiconductors suffer from relatively low charge carrier mobilities. Therefore, expressions derived for inorganic solar cells to correlate characteristic performance parameters to material properties are prone to fail when applied to organic devices. This is especially true for the classical Shockley-equation commonly used to describe current-voltage (JV)-curves, as it assumes a high electrical conductivity of the charge transporting material. Here, an analytical expression for the JV-curves of organic solar cells is derived based on a previously published analytical model. This expression, bearing a similar functional dependence as the Shockley-equation, delivers a new figure of merit α to express the balance between free charge recombination and extraction in low mobility photoactive materials. This figure of merit is shown to determine critical device parameters such as the apparent series resistance and the fill factor.},
  language  = {en}
}
@misc{KurpiersNeher2016,
  author    = {Kurpiers, Jona and Neher, Dieter},
  title     = {Dispersive Non-Geminate Recombination in an Amorphous Polymer:Fullerene Blend},
  url       = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-91541},
  pages     = {10},
  year      = {2016},
  abstract  = {Recombination of free charge is a key process limiting the performance of solar cells. For low mobility materials, such as organic semiconductors, the kinetics of non-geminate recombination (NGR) is strongly linked to the motion of charges. As these materials possess significant disorder, thermalization of photogenerated carriers in the inhomogeneously broadened density of state distribution is an unavoidable process. Despite its general importance, knowledge about the kinetics of NGR in complete organic solar cells is rather limited. We employ time delayed collection field (TDCF) experiments to study the recombination of photogenerated charge in the high-performance polymer:fullerene blend PCDTBT:PCBM. NGR in the bulk of this amorphous blend is shown to be highly dispersive, with a continuous reduction of the recombination coefficient throughout the entire time scale, until all charge carriers have either been extracted or recombined. Rapid, contact-mediated recombination is identified as an additional loss channel, which, if not properly taken into account, would erroneously suggest a pronounced field dependence of charge generation. These findings are in stark contrast to the results of TDCF experiments on photovoltaic devices made from ordered blends, such as P3HT:PCBM, where non-dispersive recombination was proven to dominate the charge carrier dynamics under application relevant conditions.},
  language  = {en}
}
@phdthesis{Herenz2016,
  author    = {Herenz, Edmund Christian},
  title     = {Detecting and understanding extragalactic Lyman α emission using 3D spectroscopy},
  url       = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-102341},
  school      = {Universit{\"a}t Potsdam},
  pages     = {175},
  year      = {2016},
  abstract  = {In this thesis we use integral-field spectroscopy to detect and understand of Lyman α (Lyα) emission from high-redshift galaxies. Intrinsically the Lyα emission at λ = 1216 {\AA} is the strongest recombination line from galaxies. It arises from the 2p → 1s transition in hydrogen. In star-forming galaxies the line is powered by ionisation of the interstellar gas by hot O- and B- stars. Galaxies with star-formation rates of 1 - 10 Msol/year are expected to have Lyα luminosities of 42 dex - 43 dex (erg/s), corresponding to fluxes ~ -17 dex - -18 dex (erg/s/cm²) at redshifts z~3, where Lyα is easily accessible with ground-based telescopes. However, star-forming galaxies do not show these expected Lyα fluxes. Primarily this is a consequence of the high-absorption cross-section of neutral hydrogen for Lyα photons σ ~ -14 dex (cm²). Therefore, in typical interstellar environments Lyα photons have to undergo a complex radiative transfer. The exact conditions under which Lyα photons can escape a galaxy are poorly understood. Here we present results from three observational projects. In Chapter 2, we show integral field spectroscopic observations of 14 nearby star-forming galaxies in Balmer α radiation (Hα, λ = 6562.8 {\AA}). These observations were obtained with the Potsdam Multi Aperture Spectrophotometer at the Calar-Alto 3.5m Telescope}. Hα directly traces the intrinsic Lyα radiation field. We present Hα velocity fields and velocity dispersion maps spatially registered onto Hubble Space Telescope Lyα and Hα images. From our observations, we conjecture a causal connection between spatially resolved Hα kinematics and Lyα photometry for individual galaxies. Statistically, we find that dispersion-dominated galaxies are more likely to emit Lyα photons than galaxies where ordered gas-motions dominate. This result indicates that turbulence in actively star-forming systems favours an escape of Lyα radiation. Not only massive stars can power Lyα radiation, but also non-thermal emission from an accreting super-massive black hole in the galaxy centre. If a galaxy harbours such an active galactic nucleus, the rate of hydrogen-ionising photons can be more than 1000 times higher than that of a typical star-forming galaxy. This radiation can potentially ionise large regions well outside the main stellar body of galaxies. Therefore, it is expected that the neutral hydrogen from these circum-galactic regions shines fluorescently in Lyα. Circum-galactic gas plays a crucial role in galaxy formation. It may act as a reservoir for fuelling star formation, and it is also subject to feedback processes that expel galactic material. If Lyα emission from this circum-galactic medium (CGM) was detected, these important processes could be studied in-situ around high-z galaxies. In Chapter 3, we show observations of five radio-quiet quasars with PMAS to search for possible extended CGM emission in the Lyα line. However, in four of the five objects, we find no significant traces of this emission. In the fifth object, there is evidence for a weak and spatially quite compact Lyα excess at several kpc outside the nucleus. The faintness of these structures is consistent with the idea that radio-quiet quasars typically reside in dark matter haloes of modest masses. While we were not able to detect Lyα CGM emission, our upper limits provide constraints for the new generation of IFS instruments at 8--10m class telescopes. The Multi Unit Spectroscopic Explorer (MUSE) at ESOs Very Large Telescopeis such an unique instrument. One of the main motivating drivers in its construction was the use as a survey instrument for Lyα emitting galaxies at high-z. Currently, we are conducting such a survey that will cover a total area of ~100 square arcminutes with 1 hour exposures for each 1 square arcminute MUSE pointing. As a first result from this survey we present in Chapter 5 a catalogue of 831 emission-line selected galaxies from a 22.2 square arcminute region in the Chandra Deep Field South. In order to construct the catalogue, we developed and implemented a novel source detection algorithm -- LSDCat -- based on matched filtering for line emission in 3D spectroscopic datasets (Chapter 4). Our catalogue contains 237 Lyα emitting galaxies in the redshift range 3 ≲ z ≲ 6. Only four of those previously had spectroscopic redshifts in the literature. We conclude this thesis with an outlook on the construction of a Lyα luminosity function based on this unique sample (Chapter 6).},
  language  = {en}
}
@misc{Guehr2016,
  author    = {G{\"u}hr, Markus},
  title     = {Ultrafast Soft X-ray Probing of Gas Phase Molecular Dynamics},
  url       = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-97215},
  year      = {2016},
  abstract  = {The molecular ability to selectively and efficiently convert sunlight into other forms of energy like heat, bond change, or charge separation is truly remarkable. The decisive steps in these transformations often happen on a femtosecond timescale and require transitions among different electronic states that violate the Born-Oppenheimer approximation (BOA). Non-BOA transitions pose challenges to both theory and experiment. From a theoretical point of view, excited state dynamics and nonadiabatic transitions both are difficult problems (see Figure 1(a)). However, the theory on non-BOA dynamics has advanced significantly over the last two decades. Full dynamical simulations for molecules of the size of nucleobases have been possible for a couple of years and allow predictions of experimental observables like photoelectron energy or ion yield. The availability of these calculations for isolated molecules has spurred new experimental efforts to develop methods that are sufficiently different from all optical techniques. For determination of transient molecular structure, femtosecond X-ray diffraction and electron diffraction have been implemented on optically excited molecules.},
  language  = {en}
}
@misc{Goychuk2016,
  author    = {Goychuk, Igor},
  title     = {Quantum ergodicity breaking in semi-classical electron transfer dynamics},
  url       = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-102264},
  pages     = {11},
  year      = {2016},
  abstract  = {Can the statistical properties of single-electron transfer events be correctly predicted within a common equilibrium ensemble description? This fundamental in nanoworld question of ergodic behavior is scrutinized within a very basic semi-classical curve-crossing problem. It is shown that in the limit of non-adiabatic electron transfer (weak tunneling) well-described by the Marcus-Levich-Dogonadze(MLD) rate the answer is yes. However, in the limit of the so-called solvent-controlled adiabatic electron transfer, a profound breaking of ergodicity occurs. Namely, a common description based on the ensemble reduced density matrix with an initial equilibrium distribution of the reaction coordinate is not able to reproduce the statistics of single-trajectory events in this seemingly classical regime. For sufficiently large activation barriers, the ensemble survival probability in a state remains nearly exponential with the inverse rate given by the sum of the adiabatic curve crossing (Kramers) time and the inverse MLD rate. In contrast, near to the adiabatic regime, the single-electron survival probability is clearly non-exponential, even though it possesses an exponential tail which agrees well with the ensemble description. Initially, it is well described by a Mittag-Leffler distribution with a fractional rate. Paradoxically, the mean transfer time in this classical on the ensemble level regime is well described by the inverse of the nonadiabatic quantum tunneling rate on a single particle level. An analytical theory is developed which perfectly agrees with stochastic simulations and explains our findings.},
  language  = {en}
}
@phdthesis{Gomez2016,
  author    = {Gomez, David},
  title     = {Mechanisms of biochemical reactions within crowded environments},
  url       = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-94593},
  school      = {Universit{\"a}t Potsdam},
  pages     = {vii, 112},
  year      = {2016},
  abstract  = {The cell interior is a highly packed environment in which biological macromolecules evolve and function. This crowded media has effects in many biological processes such as protein-protein binding, gene regulation, and protein folding. Thus, biochemical reactions that take place in such crowded conditions differ from diluted test tube conditions, and a considerable effort has been invested in order to understand such differences. In this work, we combine different computationally tools to disentangle the effects of molecular crowding on biochemical processes. First, we propose a lattice model to study the implications of molecular crowding on enzymatic reactions. We provide a detailed picture of how crowding affects binding and unbinding events and how the separate effects of crowding on binding equilibrium act together. Then, we implement a lattice model to study the effects of molecular crowding on facilitated diffusion. We find that obstacles on the DNA impair facilitated diffusion. However, the extent of this effect depends on how dynamic obstacles are on the DNA. For the scenario in which crowders are only present in the bulk solution, we find that at some conditions presence of crowding agents can enhance specific-DNA binding. Finally, we make use of structure-based techniques to look at the impact of the presence of crowders on the folding a protein. We find that polymeric crowders have stronger effects on protein stability than spherical crowders. The strength of this effect increases as the polymeric crowders become longer. The methods we propose here are general and can also be applied to more complicated systems.},
  language  = {en}
}
@misc{GhoshCherstvyPetrovetal.2016,
  author    = {Ghosh, Surya K. and Cherstvy, Andrey G. and Petrov, Eugene P. and Metzler, Ralf},
  title     = {Interactions of rod-like particles on responsive elastic sheets},
  url       = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-95882},
  year      = {2016},
  abstract  = {What are the physical laws of the mutual interactions of objects bound to cell membranes, such as various membrane proteins or elongated virus particles? To rationalise this, we here investigate by extensive computer simulations mutual interactions of rod-like particles adsorbed on the surface of responsive elastic two-dimensional sheets. Specifically, we quantify sheet deformations as a response to adhesion of such filamentous particles. We demonstrate that tip-to-tip contacts of rods are favoured for relatively soft sheets, while side-by-side contacts are preferred for stiffer elastic substrates. These attractive orientation-dependent substrate-mediated interactions between the rod-like particles on responsive sheets can drive their aggregation and self-assembly. The optimal orientation of the membrane-bound rods is established via responding to the elastic energy profiles created around the particles. We unveil the phase diagramme of attractive-repulsive rod-rod interactions in the plane of their separation and mutual orientation. Applications of our results to other systems featuring membrane-associated particles are also discussed.},
  language  = {en}
}
@phdthesis{Fournier2016,
  author    = {Fournier, Yori},
  title     = {Dynamics of the rise of magnetic flux tubes in stellar interiors},
  url       = {http://nbn-resolving.de/urn:nbn:de:kobv:517-opus4-394533},
  school      = {Universit{\"a}t Potsdam},
  pages     = {xii, 98},
  year      = {2016},
  abstract  = {In sonnen{\"a}hnlichen Sternen erh{\"a}lt ein Dynamo-Mechanismus die Magnetfelder. Der Babcock-Leighton-Dynamo beruht auf einem solchen Mechanismus und erfordert insbesondere die Existenz von magnetischen Flussr{\"o}hren. Man nimmt an, dass magnetische Flussr{\"o}hren am Boden der Konvetionszone entstehen und durch Auftrieb bis zur Oberfl{\"a}che steigen. Es wird ein spezielles Dynamomodell vorgeschlagen, in dem der Verz{\"o}gerungseffekt durch das Aufsteigen der Flussr{\"o}hren ber{\"u}cksichtigt wird. Die vorliegende Dissertation besch{\"a}ftigt sich mit der Anwendbarkeit des Babcock-Leighton-Dynamos auf andere Sterne. Zu diesem Zweck versuchen wir, die Aufstiegszeiten von magnetischen Flussr{\"o}hren mit Hilfe von kompressiblen MHD-Simulationen in sp{\"a}rischen Kugelschalen mit Dichteschichtung zu bestimmen und einzugrenzen. Derartige Simulationen sind allerdings nur in einem unrealistischen Parameterbereich m{\"o}glich. Deshalb ist eine Skalierungsrelation n{\"o}tig, die die Ergebnisse auf realistische physikalische Regimes {\"u}bertr{\"a}gt. Wir erweitern fr{\"u}here Arbeiten zu Skalierungsrelationen in 2D und leiten ein allgemeines Skalierungsgesetz ab, das f{\"u}r 2D- und 3D-Flussr{\"o}hren g{\"u}ltig ist. In einem umfangreichen Satz von numerischen Simulationen zeigen wir, dass die abgeleitete Skalierungsrelation auch im vollst{\"a}ndig nichtlinearen Fall gilt. Wir haben damit ein Gesetz f{\"u}r die Aufstiegszeit von magnetischen Flussr{\"o}hren gefunden, dass in jedem sonnen{\"a}hnlichen Stern G{\"u}ltigkeit hat. Schließlich implementieren wir dieses Gesetz in einem Dynamomodell mit Verz{\"o}gerungsterm. Die Simulationen eines solchen verz{\"o}gerten Flussr{\"o}hren/Babcock-Leighton-Dynamos auf der Basis der Meanfield-Formulierung f{\"u}hrten auf ein neues Dynamo-Regime, das nur bei Anwesenheit der Verz{\"o}gerung existiert. Die erforderlichen Verz{\"o}gerungen sind von der Gr{\"o}{\"y}enordnung der Zyklusl{\"a}nge, die resultierenden Magnetfelder sind schw{\"a}cher als die {\"A}quipartitions-Feldst{\"a}rke. Dieses neue Regime zeigt, dass auch bei sehr langen Aufstiegszeiten der Flussr{\"o}hren/Babcock-Leighton-Dynamo noch nichtzerfallende L{\"o}sungen liefern und daher auf ein breites Spektrum von Sternen anwendbar sein kann.},
  language  = {en}
}