All-electron calculation of nonadiabatic couplings from time-dependent density functional theory: Probing with the Hartree–Fock exact exchange | SAMURAI, NIMS Researchers Directory Service

HOME > Article > Detail

All-electron calculation of nonadiabatic couplings from time-dependent density functional theory: Probing with the Hartree–Fock exact exchange

Chunping Hu, Osamu Sugino, Yoshitaka Tateyama.

The Journal of Chemical Physics 131 [11] 114101. 2009.

https://doi.org/10.1063/1.3226344

NIMS author(s)

Fulltext and dataset(s) on Materials Data Repository (MDR)

Created at: 2016-05-24 15:51:53 +0900Updated at: 2024-05-01 08:59:03 +0900

▲ Go to the top of this page