Publikationen von Nicolás O. Foglia

Zeitschriftenartikel (3)

2023
Zeitschriftenartikel
Semelak, J. A.; Zeida, A.; Foglia, N. O.; Estrin, D. A. Minimum Free Energy Pathways of Reactive Processes with Nudged Elastic Bands. Journal of Chemical Theory and Computation 2023, 19, 6273–6293.
Zeitschriftenartikel
Foglia, N.; De Souza, B.; Maganas, D.; Neese, F. Including vibrational effects in magnetic circular dichroism spectrum calculations in the framework of excited state dynamics. The Journal of Chemical Physics 2023, 158, 154108.
2022
Zeitschriftenartikel
Foglia, N. O.; Maganas, D.; Neese, F. Going beyond the electric-dipole approximation in the calculation of absorption and (magnetic) circular dichroism spectra including scalar relativistic and spin–orbit coupling effects. The Journal of Chemical Physics 2022, 157, 084120.
Zur Redakteursansicht