Papers matching “charge-transfer excitations” 5
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Role of hydrogen bond alternation and charge transfer states in photoactivation of the Orange Carotenoid Protein2021 Communications Biology article Neuroscience Photoreceptor and optogenetics research Open access
Igor A. Yaroshevich, Eugene G. Maksimov, Nikolai N. Sluchanko, Dmitry V. Zlenko, Alexey V. Stepanov, Ekaterina A. Slutskaya, +19 more
46citations -
The std2 package: A computationally efficient program to calculate molecular response properties and excited states using simplified quantum chemistry methods2026 The Journal of Chemical Physics article Physics and Astronomy Advanced Chemical Physics Studies Open access
Pierre Beaujean, Axel Liger, Arya Satisha, Marilù G. Maraldi, Christoph Bannwarth, Marc de Wergifosse
1citations -
Performance of TDDFT Vertical Excitation Energies of Core‐Substituted Naphthalene Diimides2020 Journal of Computational Chemistry article Physics and Astronomy Advanced Chemical Physics Studies Open access
Ayush Kumar Narsaria, Trevor A. Hamlin, Andreas W. Ehlers, Célia Fonseca Guerra, Koop Lammertsma, F. Matthias Bickelhaupt
34citations -
Polycyclic Aromatic Hydrocarbons (PAHs) in Interstellar Ices: A Computational Study into How the Ice Matrix Influences the Ionic State of PAH Photoproducts2022 ACS Earth and Space Chemistry article Physics and Astronomy Astrophysics and Star Formation Studies Open access
Stephanie ten Brinck, Celine Nieuwland, Richard M. P. Veenboer, H. Linnartz, F. Matthias Bickelhaupt, Célia Fonseca Guerra
17citations -
Structural Disorder as the Origin of Optical Properties and Spectral Dynamics in Squaraine Nano-Aggregates2022 Journal of the American Chemical Society article Engineering Organic Electronics and Photovoltaics Open access
Robin Bernhardt, Marìck Manrho, Jennifer Zablocki, Lukas Rieland, Arne Lützen, Manuela Schiek, +5 more
19citations
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