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Sara Wirsing
Sara Wirsing
Computational Chemist, Merck KGaA
在 merckgroup.com 的电子邮件经过验证 - 首页
标题
引用次数
引用次数
年份
Methylbismuth: an organometallic bismuthinidene biradical
DP Mukhopadhyay, D Schleier, S Wirsing, J Ramler, D Kaiser, E Reusch, ...
Chemical science 11 (29), 7562-7568, 2020
502020
Excited-state dynamics in perylene-based organic semiconductor thin films: Theory meets experiment
S Wirsing, M Hänsel, V Belova, F Schreiber, K Broch, B Engels, ...
The Journal of Physical Chemistry C 123 (45), 27561-27572, 2019
252019
Geometry relaxation-mediated localization and delocalization of excitons in organic semiconductors: A quantum chemical study
M Deutsch, S Wirsing, D Kaiser, RF Fink, P Tegeder, B Engels
The Journal of Chemical Physics 153 (22), 2020
202020
Accurate polarization-resolved absorption spectra of organic semiconductor thin films using first-principles quantum-chemical methods: Pentacene as a case study
L Craciunescu, S Wirsing, S Hammer, K Broch, A Dreuw, F Fantuzzi, ...
The journal of physical chemistry letters 13 (16), 3726-3731, 2022
142022
Cluster-Based Approach Utilizing Optimally Tuned TD-DFT to Calculate Absorption Spectra of Organic Semiconductor Thin Films
L Craciunescu, M Asbach, S Wirsing, S Hammer, F Unger, K Broch, ...
Journal of Chemical Theory and Computation 19 (24), 9369-9387, 2023
42023
Adsorption Structures Affecting the Electronic Properties and Photoinduced Charge Transfer at Perylene‐Based Molecular Interfaces
S Wirsing, M Hänsel, L Craciunescu, V Belova, F Schreiber, K Broch, ...
Chemistry–An Asian Journal 18 (17), e202300386, 2023
12023
Computational Spectroscopic Studies with Focus on Organic Semiconductor Systems
S Wirsing
Universität Würzburg, 2023
2023
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