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Sheik, Haseena; Grisanti, Luca; Ostojić, Tea; Lakmuang, Chaiyaporn; Rossi, Barbara; Prlj, Antonio (2025) Investigating photodynamics of nucleobase–water systems. Physical Chemistry Chemical Physics, 27 (35). pp. 18112-18115. ISSN 1463-9076
Cigrang, Léon L. E.; Curchod, Basile F. E.; Ingle, Rebecca A.; Kelly, Aaron; Mannouch, Jonathan R.; Accomasso, Davide; Alijah, Alexander; Barbatti, Mario; Chebbi, Wiem; Došlić, Nađa; Eklund, Elliot C.; Fernandez-Alberti, Sebastian; Freibert, Antonia; González, Leticia; Granucci, Giovanni; Hernández, Federico J.; Hernández-Rodríguez, Javier; Jain, Amber; Janoš, Jiří; Kassal, Ivan; Kirrander, Adam; Lan, Zhenggang; Larsson, Henrik R.; Lauvergnat, David; Le Dé, Brieuc; Lee, Yeha; Maitra, Neepa T.; Min, Seung Kyu; Peláez, Daniel; Picconi, David; Qiu, Zixing; Raucci, Umberto; Robertson, Patrick; Sangiogo Gil, Eduarda; Sapunar, Marin; Schuerger, Peter; Sinnott, Patrick; Tretiak, Sergei; Tikku, Arkin; Vindel-Zandbergen, Patricia; Worth, Graham A.; Agostini, Federica; Gomez, Sandra; Ibele, Lea M.; Prlj, Antonio (2025) Roadmap for molecular benchmarks in nonadiabatic dynamics. The Journal of Physical Chemistry A, 129 (31). pp. 7023-7050. ISSN 1089-5639
Ievtukhov, Vladyslav; Prlj, Antonio; Ciupak, Olga; Mońka, Michał; Serdiuk, Illia E. (2025) Pursuing the holy grail of thermally activated delayed fluorescence emitters: a molecular strategy for reducing the energy gap and enhancing spin–orbit coupling. Chemical Science, 16 (25). pp. 11398-11412. ISSN 2041-6520
Tokić, Nina; Piteša, Tomislav; Prlj, Antonio; Sapunar, Marin; Došlić, Nađa (2024) Advantages and Limitations of Landau-Zener Surface Hopping Dynamics. Croatica Chemica Acta, 97 (4). ISSN 0011-1643
Prlj, Antonio; Hollas, Daniel; Curchod, Basile F. E. (2023) Deciphering the Influence of Ground-State Distributions on the Calculation of Photolysis Observables. The Journal of Physical Chemistry A, 127 (35). pp. 7400-7409. ISSN 1089-5639