TY - JOUR A1 - Smirnov, Artem A1 - Berrendorf, Max A1 - Shprits, Yuri Y. A1 - Kronberg, Elena A. A1 - Allison, Hayley J. A1 - Aseev, Nikita A1 - Zhelavskaya, Irina A1 - Morley, Steven K. A1 - Reeves, Geoffrey D. A1 - Carver, Matthew R. A1 - Effenberger, Frederic T1 - Medium energy electron flux in earth's outer radiation belt (MERLIN) BT - a Machine learning model JF - Space weather : the international journal of research and applications N2 - The radiation belts of the Earth, filled with energetic electrons, comprise complex and dynamic systems that pose a significant threat to satellite operation. While various models of electron flux both for low and relativistic energies have been developed, the behavior of medium energy (120-600 keV) electrons, especially in the MEO region, remains poorly quantified. At these energies, electrons are driven by both convective and diffusive transport, and their prediction usually requires sophisticated 4D modeling codes. In this paper, we present an alternative approach using the Light Gradient Boosting (LightGBM) machine learning algorithm. The Medium Energy electRon fLux In Earth's outer radiatioN belt (MERLIN) model takes as input the satellite position, a combination of geomagnetic indices and solar wind parameters including the time history of velocity, and does not use persistence. MERLIN is trained on >15 years of the GPS electron flux data and tested on more than 1.5 years of measurements. Tenfold cross validation yields that the model predicts the MEO radiation environment well, both in terms of dynamics and amplitudes o f flux. Evaluation on the test set shows high correlation between the predicted and observed electron flux (0.8) and low values of absolute error. The MERLIN model can have wide space weather applications, providing information for the scientific community in the form of radiation belts reconstructions, as well as industry for satellite mission design, nowcast of the MEO environment, and surface charging analysis. KW - machine learning KW - radiation belts KW - electron flux KW - empirical modeling KW - magnetosphere KW - electrons Y1 - 2020 U6 - https://doi.org/10.1029/2020SW002532 SN - 1542-7390 VL - 18 IS - 11 PB - American geophysical union, AGU CY - Washington ER - TY - JOUR A1 - Erler, Alexander A1 - Riebe, Daniel A1 - Beitz, Toralf A1 - Löhmannsröben, Hans-Gerd A1 - Grothusheitkamp, Daniela A1 - Kunz, Thomas A1 - Methner, Frank-Jürgen T1 - Characterization of volatile metabolites formed by molds on barley by mass and ion mobility spectrometry JF - Journal of mass spectrometr N2 - The contamination of barley by molds on the field or in storage leads to the spoilage of grain and the production of mycotoxins, which causes major economic losses in malting facilities and breweries. Therefore, on-site detection of hidden fungus contaminations in grain storages based on the detection of volatile marker compounds is of high interest. In this work, the volatile metabolites of 10 different fungus species are identified by gas chromatography (GC) combined with two complementary mass spectrometric methods, namely, electron impact (EI) and chemical ionization at atmospheric pressure (APCI)-mass spectrometry (MS). The APCI source utilizes soft X-radiation, which enables the selective protonation of the volatile metabolites largely without side reactions. Nearly 80 volatile or semivolatile compounds from different substance classes, namely, alcohols, aldehydes, ketones, carboxylic acids, esters, substituted aromatic compounds, alkenes, terpenes, oxidized terpenes, sesquiterpenes, and oxidized sesquiterpenes, could be identified. The profiles of volatile and semivolatile metabolites of the different fungus species are characteristic of them and allow their safe differentiation. The application of the same GC parameters and APCI source allows a simple method transfer from MS to ion mobility spectrometry (IMS), which permits on-site analyses of grain stores. Characterization of IMS yields limits of detection very similar to those of APCI-MS. Accordingly, more than 90% of the volatile metabolites found by APCI-MS were also detected in IMS. In addition to different fungus genera, different species of one fungus genus could also be differentiated by GC-IMS. KW - APCI KW - fungus KW - gas chromatography KW - ion mobility spectrometry KW - mass KW - spectrometry KW - mold KW - soft X-ray Y1 - 2020 U6 - https://doi.org/10.1002/jms.4501 SN - 1076-5174 SN - 1096-9888 VL - 55 IS - 5 SP - 1 EP - 10 PB - Wiley CY - Hoboken ER - TY - JOUR A1 - Chen, Junchao A1 - Lange, Thomas A1 - Andjelkovic, Milos A1 - Simevski, Aleksandar A1 - Krstić, Miloš T1 - Prediction of solar particle events with SRAM-based soft error rate monitor and supervised machine learning JF - Microelectronics reliability N2 - This work introduces an embedded approach for the prediction of Solar Particle Events (SPEs) in space applications by combining the real-time Soft Error Rate (SER) measurement with SRAM-based detector and the offline trained machine learning model. The proposed approach is intended for the self-adaptive fault-tolerant multiprocessing systems employed in space applications. With respect to the state-of-the-art, our solution allows for predicting the SER 1 h in advance and fine-grained hourly tracking of SER variations during SPEs as well as under normal conditions. Therefore, the target system can activate the appropriate mechanisms for radiation hardening before the onset of high radiation levels. Based on the comparison of five different machine learning algorithms trained with the public space flux database, the preliminary results indicate that the best prediction accuracy is achieved with the recurrent neural network (RNN) with long short-term memory (LSTM). Y1 - 2020 U6 - https://doi.org/10.1016/j.microrel.2020.113799 SN - 0026-2714 VL - 114 PB - Elsevier CY - Oxford ER - TY - THES A1 - Aseev, Nikita T1 - Modeling and understanding dynamics of charged particles in the Earth's inner magnetosphere T1 - Modellierung und Untersuchung der Dynamik geladener Teilchen in der inneren Magnetosphäre der Erde N2 - The Earth's inner magnetosphere is a very dynamic system, mostly driven by the external solar wind forcing exerted upon the magnetic field of our planet. Disturbances in the solar wind, such as coronal mass ejections and co-rotating interaction regions, cause geomagnetic storms, which lead to prominent changes in charged particle populations of the inner magnetosphere - the plasmasphere, ring current, and radiation belts. Satellites operating in the regions of elevated energetic and relativistic electron fluxes can be damaged by deep dielectric or surface charging during severe space weather events. Predicting the dynamics of the charged particles and mitigating their effects on the infrastructure is of particular importance, due to our increasing reliance on space technologies. The dynamics of particles in the plasmasphere, ring current, and radiation belts are strongly coupled by means of collisions and collisionless interactions with electromagnetic fields induced by the motion of charged particles. Multidimensional numerical models simplify the treatment of transport, acceleration, and loss processes of these particles, and allow us to predict how the near-Earth space environment responds to solar storms. The models inevitably rely on a number of simplifications and assumptions that affect model accuracy and complicate the interpretation of the results. In this dissertation, we quantify the processes that control electron dynamics in the inner magnetosphere, paying particular attention to the uncertainties of the employed numerical codes and tools. We use a set of convenient analytical solutions for advection and diffusion equations to test the accuracy and stability of the four-dimensional Versatile Electron Radiation Belt (VERB-4D) code. We show that numerical schemes implemented in the code converge to the analytical solutions and that the VERB-4D code demonstrates stable behavior independent of the assumed time step. The order of the numerical scheme for the convection equation is demonstrated to affect results of ring current and radiation belt simulations, and it is crucially important to use high-order numerical schemes to decrease numerical errors in the model. Using the thoroughly tested VERB-4D code, we model the dynamics of the ring current electrons during the 17 March 2013 storm. The discrepancies between the model and observations above 4.5 Earth's radii can be explained by uncertainties in the outer boundary conditions. Simulation results indicate that the electrons were transported from the geostationary orbit towards the Earth by the global-scale electric and magnetic fields. We investigate how simulation results depend on the input models and parameters. The model is shown to be particularly sensitive to the global electric field and electron lifetimes below 4.5 Earth's radii. The effects of radial diffusion and subauroral polarization streams are also quantified. We developed a data-assimilative code that blends together a convection model of energetic electron transport and loss and Van Allen Probes satellite data by means of the Kalman filter. We show that the Kalman filter can correct model uncertainties in the convection electric field, electron lifetimes, and boundary conditions. It is also demonstrated how the innovation vector - the difference between observations and model prediction - can be used to identify physical processes missing in the model of energetic electron dynamics. We computed radial profiles of phase space density of ultrarelativistic electrons, using Van Allen Probes measurements. We analyze the shape of the profiles during geomagnetically quiet and disturbed times and show that the formation of new local minimums in the radial profiles coincides with the ground observations of electromagnetic ion-cyclotron (EMIC) waves. This correlation indicates that EMIC waves are responsible for the loss of ultrarelativistic electrons from the heart of the outer radiation belt into the Earth's atmosphere. N2 - Die innere Magnetosphäre der Erde ist ein sehr dynamisches System, das hauptsächlich vom äußeren Sonnenwind beeinflusst wird, der auf das Magnetfeld unseres Planeten einwirkt. Störungen im Sonnenwind, wie z.B. koronale Massenauswürfe und sogenannte Korotierende Wechselwirkungsbereiche, verursachen geomagnetische Stürme, die zu deutlichen Veränderungen der Populationen geladener Teilchen in der inneren Magnetosphäre führen - Plasmasphäre, Ringstrom und Strahlungsgürtel. Satelliten, die in Regionen mit erhöhten energetischen und relativistischen Elektronenflüssen betrieben werden, können durch tiefe dielektrische Ladung oder Oberflächenladungen bei schweren Weltraumwetterereignissen beschädigt werden. Die Vorhersage der Dynamik der geladenen Teilchen und die Abschwächung ihrer Auswirkungen auf die Infrastruktur sind heutzutage von besonderer Bedeutung, insbesondere aufgrund unserer zunehmenden Abhängigkeit von Weltraumtechnologien. Die Dynamik von Teilchen in der Plasmasphäre, des Ringstrom und in den Strahlungsgürteln sind durch Kollisionen und kollisionsfreie Wechselwirkungen mit elektromagnetischen Feldern, die durch die Bewegung geladener Teilchen induziert werden, stark gekoppelt. Mehrdimensionale numerische Modelle vereinfachen die Betrachtung von Transport-, Beschleunigungs- und Verlustprozessen dieser Partikel und ermöglichen es uns, vorherzusagen, wie die erdnahe Weltraumumgebung auf Sonnenstürme reagiert. Die Modelle beruhen zwangsläufig auf einer Reihe von Vereinfachungen und Voraussetzungen, die sich auf die Modellgenauigkeit auswirken und die Interpretation der Ergebnisse erschweren. In dieser Dissertation quantifizieren wir die Prozesse, die die Dynamik der Elektronen in der inneren Magnetosphäre steuern. Dabei richten wir den Fokus insbesondere auch auf die Unsicherheiten der verwendeten numerischen Codes. Wir verwenden eine Reihe praktischer analytischer Lösungen für Advektions- und Diffusionsgleichungen, um die Genauigkeit und Stabilität des 4-dimensionalen ''Versatile Electron Radiation Belt'' Codes (VERB-4D Code) zu testen. Wir zeigen, dass die im Code implementierten numerischen Schemata zu den analytischen Lösungen konvergieren und der Code sich unabhängig vom angenommenen Zeitschritt stabil verhält. Wir demonstrieren, wie die Genauigkeit des numerischen Schemas für die Konvektionsgleichung die Ergebnisse von Ringstrom- und Strahlungsgürtelsimulationen beeinflussen kann, und dass es von entscheidender Beteutung ist, numerische Schemata höherer Ordnung zu verwenden, um numerische Fehler im Modell zu reduzieren. Mit dem ausführlich getesteten VERB-4D Code modellieren wir die Dynamik der Ringstromelektronen während des Sturms vom 17. März 2013. Wir zeigen, dass die Diskrepanzen zwischen dem Modell und Beobachtungen oberhalb von 4.5 Erdradien durch Unsicherheiten in den äußeren Randbedingungen erklärt werden können und dass die Elektronen durch die globalen elektrischen und magnetischen Felder von der geostationäre Umlaufbahn zur Erde transportiert wurden. Wir untersuchen weiterhin, wie die Simulationsergebnisse von den Eingabemodellen und Parametern abhängen. Wir zeigen, dass das Modell besonders empfindlich für das globale elektrische Feld und die Lebensdauer der Elektronen unterhalb von 4.5 Erdradien ist. Außerdem quantifizieren wir auch die Auswirkungen von radialer Diffusion und subauroralen Polarisationsströmen. Wir haben einen datenassimilativen Code entwickelt, der mithilfe des Kalman-Filters ein Konvektionsmodell für den Transport und den Verlust energetischer Elektronen mit den Satellitendaten der Van Allen Probes kombiniert. Wir zeigen, dass die Verwendung eines Kalman-Filters Modellunsicherheiten im elektrischen Konvektionsfeld, in der Lebensdauer der Elektronen und in den Randbedingungen korrigieren kann. Weiterhin zeigen wir, wie der Innovationsvektor - die Differenz zwischen Beobachtungen und Modellvorhersagen - verwendet werden kann, um physikalische Prozesse zu identifizieren, die im Modell der Dynamik der energetischen Elektronen fehlen. Außerdem berechnen wir radiale Profile der Phasenraumdichte ultrarelativistischer Elektronen mithilfe von Van Allen Probes-Messungen. Wir analysieren die Form der Profile und zeigen, dass die Entstehung neuer lokaler Minima in den radialen Profilen mit den Bodenbeobachtungen von EMIC-Wellen übereinstimmt. Diese Korrelation legt nahe, dass EMIC-Wellen für den Verlust ultrarelativistischer Elektronen vom Herzen des äußeren Strahlungsgürtels in die Erdatmosphäre verantwortlich sind. KW - ring current electrons KW - radiation belts KW - mathematical modeling KW - wave-particle interactions KW - data assimilation KW - Ringstromelektronen KW - Strahlungsgürtel KW - mathematische Modellierung KW - Wellen-Teilchen Wechselwirkungen KW - Datenassimilation Y1 - 2020 U6 - http://nbn-resolving.de/urn/resolver.pl?urn:nbn:de:kobv:517-opus4-479211 ER - TY - JOUR A1 - Perdigón-Toro, Lorena A1 - Zhang, Huotian A1 - Markina, Anastaa si A1 - Yuan, Jun A1 - Hosseini, Seyed Mehrdad A1 - Wolff, Christian Michael A1 - Zuo, Guangzheng A1 - Stolterfoht, Martin A1 - Zou, Yingping A1 - Gao, Feng A1 - Andrienko, Denis A1 - Shoaee, Safa A1 - Neher, Dieter T1 - Barrierless free charge generation in the high-performance PM6:Y6 bulk heterojunction non-fullerene solar cell JF - Advanced materials N2 - Organic solar cells are currently experiencing a second golden age thanks to the development of novel non-fullerene acceptors (NFAs). Surprisingly, some of these blends exhibit high efficiencies despite a low energy offset at the heterojunction. Herein, free charge generation in the high-performance blend of the donor polymer PM6 with the NFA Y6 is thoroughly investigated as a function of internal field, temperature and excitation energy. Results show that photocurrent generation is essentially barrierless with near-unity efficiency, regardless of excitation energy. Efficient charge separation is maintained over a wide temperature range, down to 100 K, despite the small driving force for charge generation. Studies on a blend with a low concentration of the NFA, measurements of the energetic disorder, and theoretical modeling suggest that CT state dissociation is assisted by the electrostatic interfacial field which for Y6 is large enough to compensate the Coulomb dissociation barrier. KW - driving force KW - non-fullerene acceptors KW - organic solar cells KW - photocurrent generation Y1 - 2020 U6 - https://doi.org/10.1002/adma.201906763 SN - 0935-9648 SN - 1521-4095 VL - 32 IS - 9 PB - Wiley-VCH CY - Weinheim ER - TY - JOUR A1 - Sandberg, Oskar J. A1 - Kurpiers, Jona A1 - Stolterfoht, Martin A1 - Neher, Dieter A1 - Meredith, Paul A1 - Shoaee, Safa A1 - Armin, Ardalan T1 - On the question of the need for a built-in potential in Perovskite solar cells JF - Advanced materials interfaces N2 - Perovskite semiconductors as the active materials in efficient solar cells exhibit free carrier diffusion lengths on the order of microns at low illumination fluxes and many hundreds of nanometers under 1 sun conditions. These lengthscales are significantly larger than typical junction thicknesses, and thus the carrier transport and charge collection should be expected to be diffusion controlled. A consensus along these lines is emerging in the field. However, the question as to whether the built-in potential plays any role is still of matter of some conjecture. This important question using phase-sensitive photocurrent measurements and theoretical device simulations based upon the drift-diffusion framework is addressed. In particular, the role of the built-in electric field and charge-selective transport layers in state-of-the-art p-i-n perovskite solar cells comparing experimental findings and simulation predictions is probed. It is found that while charge collection in the junction does not require a drift field per se, a built-in potential is still needed to avoid the formation of reverse electric fields inside the active layer, and to ensure efficient extraction through the charge transport layers. KW - built-in potential KW - charge collection KW - charge transport layers KW - perovskite solar cells Y1 - 2020 U6 - https://doi.org/10.1002/admi.202000041 SN - 2196-7350 VL - 7 IS - 10 PB - Wiley CY - Hoboken ER - TY - JOUR A1 - Jiang, Wei A1 - Tao, Chen A1 - Stolterfoht, Martin A1 - Jin, Hui A1 - Stephen, Meera A1 - Lin, Qianqian A1 - Nagiri, Ravi C. R. A1 - Burn, Paul L. A1 - Gentle, Ian R. T1 - Hole-transporting materials for low donor content organic solar cells BT - charge transport and device performance JF - Organic electronics : physics, materials and applications N2 - Low donor content solar cells are an intriguing class of photovoltaic device about which there is still considerable discussion with respect to their mode of operation. We have synthesized a series of triphenylamine-based materials for use in low donor content devices with the electron accepting [6,6]-phenyl-C71-butyric acid methyl ester (PC(7)0BM). The triphenylamine-based materials absorb light in the near UV enabling the PC(7)0BM to be be the main light absorbing organic semiconducting material in the solar cell. It was found that the devices did not operate as classical Schottky junctions but rather photocurrent was generated by hole transfer from the photo-excited PC(7)0BM to the triphenylamine-based donors. We found that replacing the methoxy surface groups with methyl groups on the donor material led to a decrease in hole mobility for the neat films, which was due to the methyl substituted materials having the propensity to aggregate. The thermodynamic drive to aggregate was advantageous for the performance of the low donor content (6 wt%) films. It was found that the 6 wt% donor devices generally gave higher performance than devices containing 50 wt% of the donor. KW - photoexcited hole transfer KW - photocurrent generation KW - synthesis KW - hole KW - mobility KW - low donor content KW - Schottky junction Y1 - 2020 U6 - https://doi.org/10.1016/j.orgel.2019.105480 SN - 1566-1199 SN - 1878-5530 VL - 76 PB - Elsevier CY - Amsterdam ER - TY - GEN A1 - Wolff, Christian Michael A1 - Canil, Laura A1 - Rehermann, Carolin A1 - Nguyen, Ngoc Linh A1 - Zu, Fengshuo A1 - Ralaiarisoa, Maryline A1 - Caprioglio, Pietro A1 - Fiedler, Lukas A1 - Stolterfoht, Martin A1 - Kogikoski, Junior, Sergio A1 - Bald, Ilko A1 - Koch, Norbert A1 - Unger, Eva L. A1 - Dittrich, Thomas A1 - Abate, Antonio A1 - Neher, Dieter T1 - Correction to 'Perfluorinated self-assembled monolayers enhance the stability and efficiency of inverted perovskite solar cells' (2020, 14 (2), 1445−1456) T2 - ACS nano Y1 - 2020 U6 - https://doi.org/10.1021/acsnano.0c08081 SN - 1936-0851 SN - 1936-086X VL - 14 IS - 11 SP - 16156 EP - 16156 PB - American Chemical Society CY - Washington, DC ER - TY - JOUR A1 - Kirchartz, Thomas A1 - Márquez, José A. A1 - Stolterfoht, Martin A1 - Unold, Thomas T1 - Photoluminescence-based characterization of halide perovskites for photovoltaics JF - Advanced Energy Materials N2 - Photoluminescence spectroscopy is a widely applied characterization technique for semiconductor materials in general and halide perovskite solar cell materials in particular. It can give direct information on the recombination kinetics and processes as well as the internal electrochemical potential of free charge carriers in single semiconductor layers, layer stacks with transport layers, and complete solar cells. The correct evaluation and interpretation of photoluminescence requires the consideration of proper excitation conditions, calibration and application of the appropriate approximations to the rather complex theory, which includes radiative recombination, non-radiative recombination, interface recombination, charge transfer, and photon recycling. In this article, an overview is given of the theory and application to specific halide perovskite compositions, illustrating the variables that should be considered when applying photoluminescence analysis in these materials. KW - metal halide perovskites KW - numerical simulations KW - photoluminescence KW - photon recycling Y1 - 2020 U6 - https://doi.org/10.1002/aenm.201904134 SN - 1614-6832 SN - 1614-6840 VL - 10 IS - 26 SP - 1 EP - 21 PB - Wiley CY - Weinheim ER - TY - GEN A1 - Kirchartz, Thomas A1 - Márquez, José A. A1 - Stolterfoht, Martin A1 - Unold, Thomas T1 - Photoluminescence-based characterization of halide perovskites for photovoltaics T2 - Zweitveröffentlichungen der Universität Potsdam : Mathematisch-Naturwissenschaftliche Reihe N2 - Photoluminescence spectroscopy is a widely applied characterization technique for semiconductor materials in general and halide perovskite solar cell materials in particular. It can give direct information on the recombination kinetics and processes as well as the internal electrochemical potential of free charge carriers in single semiconductor layers, layer stacks with transport layers, and complete solar cells. The correct evaluation and interpretation of photoluminescence requires the consideration of proper excitation conditions, calibration and application of the appropriate approximations to the rather complex theory, which includes radiative recombination, non-radiative recombination, interface recombination, charge transfer, and photon recycling. In this article, an overview is given of the theory and application to specific halide perovskite compositions, illustrating the variables that should be considered when applying photoluminescence analysis in these materials. T3 - Zweitveröffentlichungen der Universität Potsdam : Mathematisch-Naturwissenschaftliche Reihe - 1419 KW - metal halide perovskites KW - numerical simulations KW - photoluminescence KW - photon recycling Y1 - 2020 U6 - http://nbn-resolving.de/urn/resolver.pl?urn:nbn:de:kobv:517-opus4-519702 SN - 1866-8372 IS - 26 ER - TY - JOUR A1 - Wang, Qiong A1 - Smith, Joel A. A1 - Skroblin, Dieter A1 - Steele, Julian A. A1 - Wolff, Christian Michael A1 - Caprioglio, Pietro A1 - Stolterfoht, Martin A1 - Köbler, Hans A1 - Turren-Cruz, Silver-Hamill A1 - Li, Meng A1 - Gollwitzer, Christian A1 - Neher, Dieter A1 - Abate, Antonio T1 - Managing phase purities and crystal orientation for high-performance and photostable cesium lead halide perovskite solar cells JF - Solar RRL N2 - 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. KW - cesium lead halides KW - crystal orientation KW - inorganic perovskites KW - ISOS-L-1I protocol KW - phase purity KW - photostability Y1 - 2020 VL - 4 IS - 9 PB - WILEY-VCH CY - Weinheim ER - TY - JOUR A1 - Samson, Stephanie A1 - Rech, Jeromy A1 - Perdigón-Toro, Lorena A1 - Peng, Zhengxing A1 - Shoaee, Safa A1 - Ade, Harald A1 - Neher, Dieter A1 - Stolterfoht, Martin A1 - You, Wei T1 - Organic solar cells with large insensitivity to donor polymer molar mass across all acceptor classes JF - ACS applied polymer materials N2 - Donor polymer number-average molar mass (M-n) has long been known to influence organic photovoltaic (OPV) performance via changes in both the polymer properties and the resulting bulk heterojunction morphology. The exact nature of these M-n effects varies from system to system, although there is generally some intermediate M-n that results in optimal performance. Interestingly, our earlier work with the difluorobenzotriazole (FTAZ)-based donor polymer, paired with either N2200 (polymer acceptor) or PC61BM (fullerene acceptor), PcBm demonstrated <10% variation in power conversion efficiency and a consistent morphology over a large span of M-n (30 kg/mol to over 100 kg/mol). Would such insensitivity to polymer M-n still hold true when prevailing small molecular acceptors were used with FTAZ? To answer this question, we explored the impact of FTAZ on OPVs with ITIC, a high-performance small-molecule fused-ring electron acceptor (FREA). By probing the photovoltaic characteristics of the resulting OPVs, we show that a similar FTAZ mn insensitivity is also found in the FTAZ:ITIC system. This study highlights a single-donor polymer which, when paired with an archetypal fullerene, polymer, and FREA, results in systems that are largely insensitive to donor M. Our results may have implications in polymer batch-to-batch reproducibility, in particular, relaxing the need for tight M-n control during synthesis. KW - polymer solar cells KW - conjugated polymers KW - fullerenes KW - fluorination KW - molecular weight KW - non-fullerene acceptors KW - power conversion efficiency Y1 - 2020 U6 - https://doi.org/10.1021/acsapm.0c01041 SN - 2637-6105 VL - 2 IS - 11 SP - 5300 EP - 5308 PB - American Chemical Society CY - Washington ER - TY - GEN A1 - Schulze, Patricia S. C. A1 - Bett, Alexander J. A1 - Bivour, Martin A1 - Caprioglio, Pietro A1 - Gerspacher, Fabian M. A1 - Kabaklı, Özde Ş. A1 - Richter, Armin A1 - Stolterfoht, Martin A1 - Zhang, Qinxin A1 - Neher, Dieter A1 - Hermle, Martin A1 - Hillebrecht, Harald A1 - Glunz, Stefan W. A1 - Goldschmidt, Jan Christoph T1 - 25.1% high-efficiency monolithic perovskite silicon tandem solar cell with a high bandgap perovskite absorber T2 - Postprints der Universität Potsdam : Mathematisch-Naturwissenschaftliche Reihe N2 - Monolithic perovskite silicon tandem solar cells can overcome the theoretical efficiency limit of silicon solar cells. This requires an optimum bandgap, high quantum efficiency, and high stability of the perovskite. Herein, a silicon heterojunction bottom cell is combined with a perovskite top cell, with an optimum bandgap of 1.68 eV in planar p-i-n tandem configuration. A methylammonium-free FA(0.75)Cs(0.25)Pb(I0.8Br0.2)(3) perovskite with high Cs content is investigated for improved stability. A 10% molarity increase to 1.1 m of the perovskite precursor solution results in approximate to 75 nm thicker absorber layers and 0.7 mA cm(-2) higher short-circuit current density. With the optimized absorber, tandem devices reach a high fill factor of 80% and up to 25.1% certified efficiency. The unencapsulated tandem device shows an efficiency improvement of 2.3% (absolute) over 5 months, showing the robustness of the absorber against degradation. Moreover, a photoluminescence quantum yield analysis reveals that with adapted charge transport materials and surface passivation, along with improved antireflection measures, the high bandgap perovskite absorber has the potential for 30% tandem efficiency in the near future. T3 - Zweitveröffentlichungen der Universität Potsdam : Mathematisch-Naturwissenschaftliche Reihe - 1197 KW - heterojunction silicon solar cells KW - interfaces KW - perovskite solar cells KW - tandem solar cells KW - thin films Y1 - 2020 U6 - http://nbn-resolving.de/urn/resolver.pl?urn:nbn:de:kobv:517-opus4-525668 SN - 1866-8372 IS - 7 ER - TY - JOUR A1 - Schulze, Patricia S. C. A1 - Bett, Alexander J. A1 - Bivour, Martin A1 - Caprioglio, Pietro A1 - Gerspacher, Fabian M. A1 - Kabaklı, Özde Ş. A1 - Richter, Armin A1 - Stolterfoht, Martin A1 - Zhang, Qinxin A1 - Neher, Dieter A1 - Hermle, Martin A1 - Hillebrecht, Harald A1 - Glunz, Stefan W. A1 - Goldschmidt, Jan Christoph T1 - 25.1% high-efficiency monolithic perovskite silicon tandem solar cell with a high bandgap perovskite absorber JF - Solar RRL N2 - Monolithic perovskite silicon tandem solar cells can overcome the theoretical efficiency limit of silicon solar cells. This requires an optimum bandgap, high quantum efficiency, and high stability of the perovskite. Herein, a silicon heterojunction bottom cell is combined with a perovskite top cell, with an optimum bandgap of 1.68 eV in planar p-i-n tandem configuration. A methylammonium-free FA(0.75)Cs(0.25)Pb(I0.8Br0.2)(3) perovskite with high Cs content is investigated for improved stability. A 10% molarity increase to 1.1 m of the perovskite precursor solution results in approximate to 75 nm thicker absorber layers and 0.7 mA cm(-2) higher short-circuit current density. With the optimized absorber, tandem devices reach a high fill factor of 80% and up to 25.1% certified efficiency. The unencapsulated tandem device shows an efficiency improvement of 2.3% (absolute) over 5 months, showing the robustness of the absorber against degradation. Moreover, a photoluminescence quantum yield analysis reveals that with adapted charge transport materials and surface passivation, along with improved antireflection measures, the high bandgap perovskite absorber has the potential for 30% tandem efficiency in the near future. KW - heterojunction silicon solar cells KW - interfaces KW - perovskite solar cells KW - tandem solar cells KW - thin films Y1 - 2020 VL - 4 IS - 7 PB - John Wiley & Sons, Inc. CY - New Jersey ER - TY - JOUR A1 - Raoufi, Meysam A1 - Hörmann, Ulrich A1 - Ligorio, Giovanni A1 - Hildebrandt, Jana A1 - Pätzel, Michael A1 - Schultz, Thorsten A1 - Perdigón-Toro, Lorena A1 - Koch, Norbert A1 - List-Kratochvil, Emil A1 - Hecht, Stefan A1 - Neher, Dieter T1 - Simultaneous effect of ultraviolet radiation and surface modification on the work function and hole injection properties of ZnO thin films JF - Physica Status Solidi. A , Applications and materials science N2 - The combined effect of ultraviolet (UV) light soaking and self-assembled monolayer deposition on the work function (WF) of thin ZnO layers and on the efficiency of hole injection into the prototypical conjugated polymer poly(3-hexylthiophen-2,5-diyl) (P3HT) is systematically investigated. It is shown that the WF and injection efficiency depend strongly on the history of UV light exposure. Proper treatment of the ZnO layer enables ohmic hole injection into P3HT, demonstrating ZnO as a potential anode material for organic optoelectronic devices. The results also suggest that valid conclusions on the energy-level alignment at the ZnO/organic interfaces may only be drawn if the illumination history is precisely known and controlled. This is inherently problematic when comparing electronic data from ultraviolet photoelectron spectroscopy (UPS) measurements carried out under different or ill-defined illumination conditions. KW - charge injection across hybrid interfaces KW - energy-level alignments KW - hybrid metal oxides KW - organic interfaces Y1 - 2020 U6 - https://doi.org/10.1002/pssa.201900876 SN - 1862-6300 SN - 1862-6319 VL - 217 IS - 5 SP - 1 EP - 6 PB - Wiley-VCH CY - Weinheim ER - TY - THES A1 - Jay, Raphael Martin T1 - Principles of charge distribution and separation BT - the case of iron complexes probed by X-ray spectroscopy N2 - The electronic charge distributions of transition metal complexes fundamentally determine their chemical reactivity. Experimental access to the local valence electronic structure is therefore crucial in order to determine how frontier orbitals are delocalized between different atomic sites and electronic charge is spread throughout the transition metal complex. To that end, X-ray spectroscopies are employed in this thesis to study a series of solution-phase iron complexes with respect to the response of their local electronic charge distributions to different external influences. Using resonant inelastic X-ray scattering (RIXS) and X-ray absorption spectroscopy (XAS) at the iron L-edge, changes in local charge densities are investigated at the iron center depending on different ligand cages as well as solvent environments. A varying degree of charge delocalization from the metal center onto the ligands is observed, which is governed by the capabilities of the ligands to accept charge density into their unoccupied orbitals. Specific solvents are furthermore shown to amplify this process. Solvent molecules of strong Lewis-acids withdraw charge from the ligand allowing in turn for more metal charge to be delocalized onto the ligand. The resulting local charge deficiencies at the metal center are, however, counteracted by competing electron-donation channels from the ligand towards the iron, which are additionally revealed. This is interpreted as a compensating effect which strives to maintain local charge densities at the iron center. This mechanism of charge density preservation is found to be of general nature. Using time-resolved RIXS and XAS at the iron L-edge, an analogous interplay of electron donation and back-donation channels is also revealed for the case of charge-transfer excited states. In such transient configurations, the electronic occupation of iron-centered frontier orbitals has been altered by an optical excitation. Changes in local charge densities that are expected to follow an increased or decreased population of iron-centered orbitals are, however, again counteracted. By scaling the degree of electron donation from the ligand onto the metal, local charge densities at the iron center can be efficiently maintained. Since charge-transfer excitations, however, often constitute the initial step in many electron transfer processes, these findings challenge common notions of charge-separation in transition metal dyes. KW - L-edge spectroscopy KW - charge-transfer excitations KW - transition metal complexes KW - electronic structure KW - photo-chemical pathways Y1 - 2020 ER - TY - GEN A1 - Wang, Qiong A1 - Smith, Joel A. A1 - Skroblin, Dieter A1 - Steele, Julian A. A1 - Wolff, Christian Michael A1 - Caprioglio, Pietro A1 - Stolterfoht, Martin A1 - Köbler, Hans A1 - Turren-Cruz, Silver-Hamill A1 - Li, Meng A1 - Gollwitzer, Christian A1 - Neher, Dieter A1 - Abate, Antonio T1 - Managing phase purities and crystal orientation for high-performance and photostable cesium lead halide perovskite solar cells T2 - Postprints der Universität Potsdam : Mathematisch-Naturwissenschaftliche Reihe N2 - 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. T3 - Zweitveröffentlichungen der Universität Potsdam : Mathematisch-Naturwissenschaftliche Reihe - 1210 KW - cesium lead halides KW - crystal orientation KW - inorganic perovskites KW - ISOS-L-1I protocol KW - phase purity KW - photostability Y1 - 2020 U6 - http://nbn-resolving.de/urn/resolver.pl?urn:nbn:de:kobv:517-opus4-525374 SN - 1866-8372 IS - 9 ER - TY - JOUR A1 - Abdalla, H. A1 - Adam, R. A1 - Aharonian, Felix A. A1 - Benkhali, F. Ait A1 - Angüner, Ekrem Oǧuzhan A1 - Arcaro, C. A1 - Armand, C. A1 - Armstrong, T. A1 - Ashkar, H. A1 - Backes, M. A1 - Baghmanyan, V. A1 - Martins, V. Barbosa A1 - Barnacka, A. A1 - Barnard, M. A1 - Becherini, Y. A1 - Berge, D. A1 - Bernlohr, K. A1 - Bi, B. A1 - Bottcher, M. A1 - Boisson, C. A1 - Bolmont, J. A1 - de Lavergne, M. de Bony A1 - Bordas, Pol A1 - Breuhaus, M. A1 - Brun, F. A1 - Brun, P. A1 - Bryan, M. A1 - Buchele, M. A1 - Bulik, T. A1 - Bylund, T. A1 - Caroff, S. A1 - Carosi, A. A1 - Casanova, Sabrina A1 - Chand, T. A1 - Chandra, S. A1 - Chen, A. A1 - Cotter, G. A1 - Curylo, M. A1 - Mbarubucyeye, J. Damascene A1 - Davids, I. D. A1 - Davies, J. A1 - Deil, C. A1 - Devin, J. A1 - deWilt, P. A1 - Dirson, L. A1 - Djannati-Atai, A. A1 - Dmytriiev, A. A1 - Donath, A. A1 - Doroshenko, V. A1 - Duffy, C. A1 - Dyks, J. A1 - Egberts, Kathrin A1 - Eichhorn, F. A1 - Einecke, S. A1 - Emery, G. A1 - Ernenwein, J. -P. A1 - Feijen, K. A1 - Fegan, S. A1 - Fiasson, A. A1 - de Clairfontaine, G. Fichet A1 - Fontaine, G. A1 - Funk, S. A1 - Fussling, Matthias A1 - Gabici, S. A1 - Gallant, Y. A. A1 - Giavitto, G. A1 - Giunti, L. A1 - Glawion, D. A1 - Glicenstein, J. F. A1 - Gottschall, D. A1 - Grondin, M. -H. A1 - Hahn, J. A1 - Haupt, M. A1 - Hermann, G. A1 - Hinton, J. A. A1 - Hofmann, W. A1 - Hoischen, Clemens A1 - Holch, T. L. A1 - Holler, M. A1 - Horbe, M. A1 - Horns, D. A1 - Huber, D. A1 - Jamrozy, M. A1 - Jankowsky, D. A1 - Jankowsky, F. A1 - Jardin-Blicq, A. A1 - Joshi, V. A1 - Jung-Richardt, I. A1 - Kasai, E. A1 - Kastendieck, M. A. A1 - Katarzynski, K. A1 - Katz, U. A1 - Khangulyan, D. A1 - Khelifi, B. A1 - Klepser, S. A1 - Kluzniak, W. A1 - Komin, Nu. A1 - Konno, R. A1 - Kosack, K. A1 - Kostunin, D. A1 - Kreter, M. A1 - Lamanna, G. A1 - Lemiere, A. A1 - Lemoine-Goumard, M. A1 - Lenain, J. -P. A1 - Levy, C. A1 - Lohse, T. A1 - Lypova, I. A1 - Mackey, J. A1 - Majumdar, J. A1 - Malyshev, D. A1 - Malyshev, D. A1 - Marandon, V. A1 - Marchegiani, P. A1 - Marcowith, Alexandre A1 - Mares, A. A1 - Marti-Devesa, G. A1 - Marx, R. A1 - Maurin, G. A1 - Meintjes, P. J. A1 - Meyer, M. A1 - Mitchell, A. A1 - Moderski, R. A1 - Mohamed, M. A1 - Mohrmann, L. A1 - Montanari, A. A1 - Moore, C. A1 - Morris, P. A1 - Moulin, Emmanuel A1 - Muller, J. A1 - Murach, T. A1 - Nakashima, K. A1 - Nayerhoda, A. A1 - de Naurois, M. A1 - Ndiyavala, H. A1 - Niederwanger, F. A1 - Niemiec, J. A1 - Oakes, L. A1 - O'Brien, Patrick A1 - Odaka, H. A1 - Ohm, S. A1 - Olivera-Nieto, L. A1 - Wilhelmi, E. de Ona A1 - Ostrowski, M. A1 - Oya, I. A1 - Panter, M. A1 - Panny, S. A1 - Parsons, R. D. A1 - Peron, G. A1 - Peyaud, B. A1 - Piel, Q. A1 - Pita, S. A1 - Poireau, V. A1 - Noel, A. Priyana A1 - Prokhorov, D. A. A1 - Prokoph, H. A1 - Puhlhofer, G. A1 - Punch, M. A1 - Quirrenbach, A. A1 - Raab, S. A1 - Rauth, R. A1 - Reichherzer, P. A1 - Reimer, A. A1 - Reimer, O. A1 - Remy, Q. A1 - Renaud, M. A1 - Rieger, F. A1 - Rinchiuso, L. A1 - Romoli, C. A1 - Rowell, G. A1 - Rudak, B. A1 - Ruiz-Velasco, E. A1 - Sahakian, V. A1 - Sailer, S. A1 - Sanchez, D. A. A1 - Santangelo, Andrea A1 - Sasaki, M. A1 - Scalici, M. A1 - Schussler, F. A1 - Schutte, H. M. A1 - Schwanke, U. A1 - Schwemmer, S. A1 - Seglar-Arroyo, M. A1 - Senniappan, M. A1 - Seyffert, A. S. A1 - Shafi, N. A1 - Shiningayamwe, K. A1 - Simoni, R. A1 - Sinha, A. A1 - Sol, H. A1 - Specovius, A. A1 - Spencer, S. A1 - Spir-Jacob, M. A1 - Stawarz, L. A1 - Sun, L. A1 - Steenkamp, R. A1 - Stegmann, C. A1 - Steinmassl, S. A1 - Steppa, C. A1 - Takahashi, T. A1 - Tavernier, T. A1 - Taylor, A. M. A1 - Terrier, R. A1 - Tiziani, D. A1 - Tluczykont, M. A1 - Tomankova, L. A1 - Trichard, C. A1 - Tsirou, M. A1 - Tuffs, R. A1 - Uchiyama, Y. A1 - van der Walt, D. J. A1 - van Eldik, C. A1 - van Rensburg, C. A1 - van Soelen, B. A1 - Vasileiadis, G. A1 - Veh, J. A1 - Venter, C. A1 - Vincent, P. A1 - Vink, J. A1 - Volk, H. J. A1 - Vuillaume, T. A1 - Wadiasingh, Z. A1 - Wagner, S. J. A1 - Watson, J. A1 - Werner, F. A1 - White, R. A1 - Wierzcholska, A. A1 - Wong, Yu Wun A1 - Yusafzai, A. A1 - Zacharias, M. A1 - Zanin, R. A1 - Zargaryan, D. A1 - Zdziarski, A. A. A1 - Zech, Alraune A1 - Zhu, S. J. A1 - Ziegler, A. A1 - Zorn, J. A1 - Zouari, S. A1 - Zywucka, N. T1 - An extreme particle accelerator in the Galactic plane BT - HESS J1826-130 JF - Astronomy and astrophysics : an international weekly journal N2 - The unidentified very-high-energy (VHE; E > 0.1 TeV) gamma -ray source, HESS J1826-130, was discovered with the High Energy Stereoscopic System (HESS) in the Galactic plane. The analysis of 215 h of HESS data has revealed a steady gamma -ray flux from HESS J1826-130, which appears extended with a half-width of 0.21 degrees +/- 0.02
(stat)degrees
stat degrees +/- 0.05
(sys)degrees sys degrees . The source spectrum is best fit with either a power-law function with a spectral index Gamma = 1.78 +/- 0.10(stat) +/- 0.20(sys) and an exponential cut-off at 15.2
(+5.5)(-3.2) -3.2+5.5 TeV, or a broken power-law with Gamma (1) = 1.96 +/- 0.06(stat) +/- 0.20(sys), Gamma (2) = 3.59 +/- 0.69(stat) +/- 0.20(sys) for energies below and above E-br = 11.2 +/- 2.7 TeV, respectively. The VHE flux from HESS J1826-130 is contaminated by the extended emission of the bright, nearby pulsar wind nebula, HESS J1825-137, particularly at the low end of the energy spectrum. Leptonic scenarios for the origin of HESS J1826-130 VHE emission related to PSR J1826-1256 are confronted by our spectral and morphological analysis. In a hadronic framework, taking into account the properties of dense gas regions surrounding HESS J1826-130, the source spectrum would imply an astrophysical object capable of accelerating the parent particle population up to greater than or similar to 200 TeV. Our results are also discussed in a multiwavelength context, accounting for both the presence of nearby supernova remnants, molecular clouds, and counterparts detected in radio, X-rays, and TeV energies. KW - ISM: supernova remnants KW - ISM: clouds KW - gamma rays: general KW - gamma rays: KW - ISM Y1 - 2020 U6 - https://doi.org/10.1051/0004-6361/202038851 SN - 0004-6361 SN - 1432-0746 VL - 644 PB - EDP Sciences CY - Les Ulis ER - TY - JOUR A1 - Cheng, Xin A1 - Zhang, Jie A1 - Kliem, Bernhard A1 - Török, Tibor A1 - Xing, Chen A1 - Zhou, Zhenjun A1 - Inhester, Bernd A1 - Ding, Mingde T1 - Initiation and early kinematic evolution of solar eruptions JF - The Astrophysical Journal N2 - We investigate the initiation and early evolution of 12 solar eruptions, including six active-region hot channel and six quiescent filament eruptions, which were well observed by the Solar Dynamics Observatory, as well as by the Solar Terrestrial Relations Observatory for the latter. The sample includes one failed eruption and 11 coronal mass ejections, with velocities ranging from 493 to 2140 km s(-1). A detailed analysis of the eruption kinematics yields the following main results. (1) The early evolution of all events consists of a slow-rise phase followed by a main-acceleration phase, the height-time profiles of which differ markedly and can be best fit, respectively, by a linear and an exponential function. This indicates that different physical processes dominate in these phases, which is at variance with models that involve a single process. (2) The kinematic evolution of the eruptions tends to be synchronized with the flare light curve in both phases. The synchronization is often but not always close. A delayed onset of the impulsive flare phase is found in the majority of the filament eruptions (five out of six). This delay and its trend to be larger for slower eruptions favor ideal MHD instability models. (3) The average decay index at the onset heights of the main acceleration is close to the threshold of the torus instability for both groups of events (although, it is based on a tentative coronal field model for the hot channels), suggesting that this instability initiates and possibly drives the main acceleration. KW - solar coronal mass ejections KW - stellar coronal mass ejections KW - solar storm Y1 - 2020 U6 - https://doi.org/10.3847/1538-4357/ab886a SN - 1055-6796 SN - 1476-3540 VL - 894 IS - 2 SP - 1 EP - 20 PB - Cambridge Scientific Publishers CY - Cambridge ER - TY - JOUR A1 - Cervantes Villa, Juan Sebastian A1 - Shprits, Yuri Y. A1 - Aseev, Nikita A1 - Allison, Hayley J. T1 - Quantifying the effects of EMIC wave scattering and magnetopause shadowing in the outer electron radiation belt by means of data assimilation JF - Journal of geophysical research : Space physics N2 - In this study we investigate two distinct loss mechanisms responsible for the rapid dropouts of radiation belt electrons by assimilating data from Van Allen Probes A and B and Geostationary Operational Environmental Satellites (GOES) 13 and 15 into a 3-D diffusion model. In particular, we examine the respective contribution of electromagnetic ion cyclotron (EMIC) wave scattering and magnetopause shadowing for values of the first adiabatic invariant mu ranging from 300 to 3,000 MeV G(-1). We inspect the innovation vector and perform a statistical analysis to quantitatively assess the effect of both processes as a function of various geomagnetic indices, solar wind parameters, and radial distance from the Earth. Our results are in agreement with previous studies that demonstrated the energy dependence of these two mechanisms. We show that EMIC wave scattering tends to dominate loss at lower L shells, and it may amount to between 10%/hr and 30%/hr of the maximum value of phase space density (PSD) over all L shells for fixed first and second adiabatic invariants. On the other hand, magnetopause shadowing is found to deplete electrons across all energies, mostly at higher L shells, resulting in loss from 50%/hr to 70%/hr of the maximum PSD. Nevertheless, during times of enhanced geomagnetic activity, both processes can operate beyond such location and encompass the entire outer radiation belt. Y1 - 2020 U6 - https://doi.org/10.1029/2020JA028208 SN - 2169-9380 SN - 2169-9402 VL - 125 IS - 8 PB - American Geophysical Union CY - Washington ER - TY - THES A1 - Köhler, Raphael T1 - Towards seasonal prediction: stratosphere-troposphere coupling in the atmospheric model ICON-NWP N2 - Stratospheric variability is one of the main potential sources for sub-seasonal to seasonal predictability in mid-latitudes in winter. Stratospheric pathways play an important role for long-range teleconnections between tropical phenomena, such as the quasi-biennial oscillation (QBO) and El Niño-Southern Oscillation (ENSO), and the mid-latitudes on the one hand, and linkages between Arctic climate change and the mid-latitudes on the other hand. In order to move forward in the field of extratropical seasonal predictions, it is essential that an atmospheric model is able to realistically simulate the stratospheric circulation and variability. The numerical weather prediction (NWP) configuration of the ICOsahedral Non-hydrostatic atmosphere model ICON is currently being used by the German Meteorological Service for the regular weather forecast, and is intended to produce seasonal predictions in future. This thesis represents the first extensive evaluation of Northern Hemisphere stratospheric winter circulation in ICON-NWP by analysing a large set of seasonal ensemble experiments. An ICON control climatology simulated with a default setup is able to reproduce the basic behaviour of the stratospheric polar vortex. However, stratospheric westerlies are significantly too weak and major stratospheric warmings too frequent, especially in January. The weak stratospheric polar vortex in ICON is furthermore connected to a mean sea level pressure (MSLP) bias pattern resembling the negative phase of the Arctic Oscillation (AO). Since a good representation of the drag exerted by gravity waves is crucial for a realistic simulation of the stratosphere, three sensitivity experiments with reduced gravity wave drag are performed. Both a reduction of the non-orographic and orographic gravity wave drag respectively, lead to a strengthening of the stratospheric vortex and thus a bias reduction in winter, in particular in January. However, the effect of the non-orographic gravity wave drag on the stratosphere is stronger. A third experiment, combining a reduced orographic and non-orographic drag, exhibits the largest stratospheric bias reductions. The analysis of stratosphere-troposphere coupling based on an index of the Northern Annular Mode demonstrates that ICON realistically represents downward coupling. This coupling is intensified and more realistic in experiments with a reduced gravity wave drag, in particular with reduced non-orographic drag. Tropospheric circulation is also affected by the reduced gravity wave drag, especially in January, when the strongly improved stratospheric circulation reduces biases in the MSLP patterns. Moreover, a retuning of the subgrid-scale orography parameterisations leads to a significant error reduction in the MSLP in all months. In conclusion, the combination of these adjusted parameterisations is recommended as a current optimal setup for seasonal simulations with ICON. Additionally, this thesis discusses further possible influences on the stratospheric polar vortex, including the influence of tropical phenomena, such as QBO and ENSO, as well as the influence of a rapidly warming Arctic. ICON does not simulate the quasi-oscillatory behaviour of the QBO and favours weak easterlies in the tropical stratosphere. A comparison with a reanalysis composite of the easterly QBO phase reveals, that the shift towards the easterly QBO in ICON further weakens the stratospheric polar vortex. On the other hand, the stratospheric reaction to ENSO events in ICON is realistic. ICON and the reanalysis exhibit a weakened stratospheric vortex in warm ENSO years. Furthermore, in particular in winter, warm ENSO events favour the negative phase of the Arctic Oscillation, whereas cold events favour the positive phase. The ICON simulations also suggest a significant effect of ENSO on the Atlantic-European sector in late winter. To investigate the influence of Arctic climate change on mid-latitude circulation changes, two differing approaches with transient and fixed sea ice conditions are chosen. Neither ICON approach exhibits the mid-latitude tropospheric negative Arctic Oscillation circulation response to amplified Arctic warming, as it is discussed on the basis of observational evidence. Nevertheless, adding a new model to the current and active discussion on Arctic-midlatitude linkages, further contributes to the understanding of divergent conclusions between model and observational studies. N2 - Die stratosphärische Variabilität ist eine der wichtigsten potentiellen Quellen für die Vorhersagbarkeit der atmosphärischen Zirkulation in den mittleren Breiten im Winter auf der Zeitskala von Wochen bis zu Jahreszeiten. Stratosphärische Prozesse spielen eine grundlegende Rolle für die Fernverbindungen (Telekonnektionen) zwischen tropischen Klimaphänomenen, wie der quasi-zweijährigen Schwingung (QBO) oder „El Niño-Südliche Oszillation“ (ENSO), und den mittleren Breiten, sowie den Telekonnektionen zwischen arktischen Klimaänderungen und der atmosphärischen Zirkulation in den mittleren Breiten. Die Fähigkeit eines atmosphärischen Modells, die stratosphärische Zirkulation und deren Variabilität realistisch zu simulieren, ist deshalb von grundlegender Bedeutung, um die Jahreszeitenvorhersage in den mittleren Breiten deutlich zu verbessern. Das nichthydrostatische Atmosphärenmodell ICON (ICOsahedral Non-hydrostatic atmosphere model) wird gegenwärtig beim Deutschen Wetterdienst (DWD) in der numerischen Wettervorhersagekonfiguration (ICON-NWP) für die Wettervorhersage genutzt, und soll zukünftig auch für Jahreszeitenvorhersagen benutzt werden. Darauf basierend, präsentiert die vorliegende Arbeit eine Vielzahl von saisonalen Ensembleexperimenten mit ICON-NWP und liefert damit die erste umfassende Bewertung der stratosphärischen Winterzirkulation der nördlichen Hemisphäre in ICON-NWP. Die Klimatologie eines ICON-Modelllaufs im Standardsetup reproduziert die grundlegenden Eigenschaften des stratosphärischen Polarwirbels. Allerdings sind die stratosphärischen Westwinde deutlich schwächer als in den Beobachtungen, und starke Stratosphärenerwärmungen treten insbesondere im Januar zu häufig auf. Zudem ist der schwache stratosphärische Polarwirbel in ICON mit einem typischen Fehler-Muster des Bodenluftdrucks verknüpft, welches der negativen Phase der Arktischen Oszillation (AO) ähnelt. Da eine gute Darstellung des von Schwerewellen ausgeübten Widerstands für eine realistische Simulation der Stratosphäre entscheidend ist, werden drei Sensitivitätsexperimente mit reduziertem Schwerewellenwiderstand durchgeführt. Sowohl eine Verringerung des nicht-orographischen, als auch eine Verringerung des orographischen Schwerewellenwiderstands führen jeweils zu einer Verstärkung des stratosphärischen Wirbels und damit zu einer Verringerung des Fehlers im Winter, insbesondere im Januar. Die Wirkung des nicht-orographischen Schwerewellenwiderstands auf die Stratosphäre ist hierbei jedoch stärker. Ein drittes Experiment, welches den reduzierten orographischen und nicht-orographischen Widerstand kombiniert, zeigt die größten Verbesserungen in der Stratosphäre. Die auf dem Index des „Northern Annular Mode“ basierende Analyse der Stratosphären-Troposphären-Kopplung zeigt, dass ICON die nach unten gerichtete Kopplung zwischen der Stratosphäre und Troposphäre realistisch darstellt. Diese Kopplung wird in Experimenten mit einem reduzierten Schwerewellenwiderstand verstärkt und realistischer dargestellt, dies gilt insbesondere für den reduzierten nicht-orographischen Widerstand. Auch die troposphärische Zirkulation wird durch den reduzierten Schwerewellenwiderstand beeinflusst, vor allem im Januar, wenn die stark verbesserte stratosphärische Zirkulation den Fehler in den Bodenluftdruckfeldern reduziert. Darüber hinaus führt ein Tuning der Parameterisierung der subgrid-skaligen orographischen Schwerewellen zu einer signifikanten Fehlerreduktion des Bodenluftdrucks in allen Monaten. Die Kombination all dieser angepassten Parametrisierungen wird als derzeit optimales Setup für Jahreszeiten-Simulationen mit ICON vorgeschlagen. Darüber hinaus werden in dieser Arbeit weitere mögliche Einflussfaktoren auf den stratosphärischen Polarwirbel diskutiert, darunter der Einfluss tropischer Phänomene, wie QBO und ENSO, sowie der Einfluss einer sich rasch erwärmenden Arktis. Das quasi-oszillierende Verhalten der QBO wird durch ICON nicht simuliert, sodass schwache Ostwinde in der tropischen Stratosphäre dominieren. Ein Vergleich mit einem Reanalyse-Komposit der östlichen QBO-Phase zeigt, dass die Verschiebung in Richtung der östlichen QBO in ICON den stratosphärischen Polarwirbel weiter abschwächt. Die stratosphärische Reaktion auf ENSO-Ereignisse in ICON ist jedoch realistisch. ICON und Reanalysedaten zeigen einen abgeschwächten Stratosphärenwirbel in warmen ENSO-Jahren. Darüber hinaus begünstigen insbesondere im Winter warme ENSO-Ereignisse die negative Phase der Arktischen Oszillation, während kalte Ereignisse die positive Phase begünstigen. Die ICON-Simulationen deuten auch auf einen signifikanten Effekt von ENSO auf den atlantisch-europäischen Sektor im Spätwinter hin. Um den Einfluss des arktischen Klimawandels auf Änderungen der Zirkulation in mittleren Breiten zu untersuchen, werden zwei unterschiedliche Ansätze mit transienten und festen Meereisgrenzen gewählt. Keiner der beiden ICON-Ansätze zeigt eine Tendenz zur negativen Phase der Arktische Oszillation als Reaktion auf die verstärkte Erwärmung der Arktis, wie sie in der Literatur anhand von Beobachtungsdaten häufig diskutiert wird. Jedoch wird somit der aktuellen und aktiven Diskussion zu den Auswirkungen des arktischen Klimawandels auf die Zirkulation der mittleren Breiten ein neues Modell hinzugefügt. T2 - Im Hinblick auf die Jahreszeitenvorhersage: Stratosphären-Troposphären-Kopplung in dem Atmosphärenmodell ICON-NWP KW - Seasonal prediction KW - Stratosphere-troposphere coupling KW - ICON KW - Stratospheric polar vortex KW - Jahreszeitenvorhersage KW - Stratosphären-Troposphären-Kopplung KW - ICON KW - Stratosphärischer Polarwirbel KW - El Niño-Southern Oscillation (ENSO) KW - El Niño-Südliche Oszillation KW - Arctic-midlatitude linkages KW - Verbindungspfade zwischen der Arktis und den mittleren Breiten Y1 - 2020 U6 - http://nbn-resolving.de/urn/resolver.pl?urn:nbn:de:kobv:517-opus4-487231 ER - TY - JOUR A1 - Schaffenroth, Veronika A1 - Casewell, Sarah L. A1 - Schneider, D. A1 - Kilkenny, David A1 - Geier, Stephan A1 - Heber, Ulrich A1 - Irrgang, Andreas A1 - Przybilla, Norbert A1 - Marsh, Thomas R. A1 - Littlefair, Stuart P. A1 - Dhillon, Vik S. T1 - A quantitative in-depth analysis of the prototype sdB plus BD system SDSS J08205+0008 revisited in the Gaia era JF - Monthly notices of the Royal Astronomical Society N2 - Subdwarf B stars are core-helium-burning stars located on the extreme horizontal branch (EHB). Extensive mass loss on the red giant branch is necessary to form them. It has been proposed that substellar companions could lead to the required mass loss when they are engulfed in the envelope of the red giant star. J08205+0008 was the first example of a hot subdwarf star with a close, substellar companion candidate to be found. Here, we perform an in-depth re-analysis of this important system with much higher quality data allowing additional analysis methods. From the higher resolution spectra obtained with ESO-VLT/XSHOOTER, we derive the chemical abundances of the hot subdwarf as well as its rotational velocity. Using the Gaia parallax and a fit to the spectral energy distribution in the secondary eclipse, tight constraints to the radius of the hot subdwarf are derived. From a long-term photometric campaign, we detected a significant period decrease of -3.2(8) x 10(-12) dd(-1). This can be explained by the non-synchronized hot subdwarf star being spun up by tidal interactions forcing it to become synchronized. From the rate of period decrease we could derive the synchronization time-scale to be 4 Myr, much smaller than the lifetime on EHB. By combining all different methods, we could constrain the hot subdwarf to a mass of 0.39-0.50 M-circle dot and a radius of R-sdB = 0.194 +/- 0.008 R-circle dot, and the companion to 0.061-0.071 M-circle dot with a radius of R-comp = 0.092 +/- 0.005 R-circle dot, below the hydrogen-burning limit. We therefore confirm that the companion is most likely a massive brown dwarf. KW - stars: abundances KW - stars: atmospheres KW - stars: fundamental parameters KW - stars: horizontal branch KW - stars: low-mass KW - subdwarfs Y1 - 2020 U6 - https://doi.org/10.1093/mnras/staa3661 SN - 0035-8711 SN - 1365-2966 VL - 501 IS - 3 SP - 3847 EP - 3870 PB - Oxford Univ. Press CY - Oxford ER - TY - JOUR A1 - Pelisoli, Ingrid A1 - Vos, Joris A1 - Geier, Stephan A1 - Schaffenroth, Veronika A1 - Baran, Andrzej S. T1 - Alone but not lonely BT - observational evidence that binary interaction is always required to form hot subdwarf stars JF - Astronomy and astrophysics : an international weekly journal N2 - Context. Hot subdwarfs are core-helium burning stars that show lower masses and higher temperatures than canonical horizontal branch stars. They are believed to be formed when a red giant suffers an extreme mass-loss episode. Binary interaction is suggested to be the main formation channel, but the high fraction of apparently single hot subdwarfs (up to 30%) has prompted single star formation scenarios to be proposed.Aims. We investigate the possibility that hot subdwarfs could form without interaction by studying wide binary systems. If single formation scenarios were possible, there should be hot subdwarfs in wide binaries that have undergone no interaction.Methods. Angular momentum accretion during interaction is predicted to cause the hot subdwarf companion to spin up to the critical velocity. The effect of this should still be observable given the timescales of the hot subdwarf phase. To study the rotation rates of companions, we have analysed light curves from the Transiting Exoplanet Survey Satellite for all known hot subdwarfs showing composite spectral energy distributions indicating the presence of a main sequence wide binary companion. If formation without interaction were possible, that would also imply the existence of hot subdwarfs in very wide binaries that are not predicted to interact. To identify such systems, we have searched for common proper motion companions with projected orbital distances of up to 0.1 pc to all known spectroscopically confirmed hot subdwarfs using Gaia DR2 astrometry.Results. We find that the companions in composite hot subdwarfs show short rotation periods when compared to field main sequence stars. They display a triangular-shaped distribution with a peak around 2.5 days, similar to what is observed for young open clusters. We also report a shortage of hot subdwarfs with candidate common proper motion companions. We identify only 16 candidates after probing 2938 hot subdwarfs with good astrometry. Out of those, at least six seem to be hierarchical triple systems, in which the hot subdwarf is part of an inner binary.Conclusions. The observed distribution of rotation rates for the companions in known wide hot subdwarf binaries provides evidence of previous interaction causing spin-up. Additionally, there is a shortage of hot subdwarfs in common proper motion pairs, considering the frequency of such systems among progenitors. These results suggest that binary interaction is always required for the formation of hot subdwarfs. KW - subdwarfs KW - binaries: general KW - stars: variables: general Y1 - 2020 U6 - https://doi.org/10.1051/0004-6361/202038473 SN - 0004-6361 SN - 1432-0746 VL - 642 PB - EDP Sciences CY - Les Ulis ER -