3 resultats trouvés
Auteur [ Titre
] Type Année Filtres: Auteur est Filippi, Claudia [Clear All Filters]
Mixed time-dependent density-functional theory/classical trajectory surface hopping study of oxirane photochemistry.,
, J. Chem. Phys., Volume 129, Number 12, p.124108/1–124108/19, (2008)
Regarding the use and misuse of retinal protonated Schiff base photochemistry as a test case for time-dependent density-functional theory.,
, J. Chem. Phys., Volume 142, Number 14, p.144104/1–144104/13, (2015)
Troubleshooting time-dependent density-functional theory for photochemical applications: Oxirane.,
, J. Chem. Phys., Volume 127, Number 16, p.164111/1–164111/18, (2007)