The effective relativistic coupling by asymptotic representation approach for molecules with multiple relativistic atoms.

Autor: Weike, Nicole, Eisfeld, Wolfgang

Publikováno v: Journal of Chemical Physics; 2/14/2024, Vol. 160 Issue 6, p1-9, 9p

Tento výsledek nelze pro nepřihlášené uživatele zobrazit.
K zobrazení výsledku je třeba se přihlásit.

NO3 full-dimensional potential energy surfaces and ground state vibrational levels revisited

Autor: Viel, Alexandra, Eisfeld, Wolfgang

Publikováno v: In Chemical Physics 15 June 2018 509:81-90

A general method for the development of diabatic spin–orbit models for multi-electron systems.

Autor: Fritsch, Fabian, Weike, Thomas, Eisfeld, Wolfgang

Publikováno v: Journal of Chemical Physics; 2/7/2022, Vol. 156 Issue 5, p1-17, 17p

Artificial Neural Networks: Toward Efficient Nonadiabatic Dynamics with Coupled Potential Energy Surfaces

Autor: Williams, David M. G., Viel, Alexandra, Eisfeld, Wolfgang, Martínez, Todd

Publikováno v: American Conference on Theoretical Chemistry
American Conference on Theoretical Chemistry, https://www.actc2022.com/, Jul 2022, Palisades Tahoe, United States

International audience

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=dedup_wf_001::760b9ef2cbb075057684b5e323b99d28
https://hal.science/hal-03976934