Nonadiabatic couplings from time-dependent density functional theory: Formulation by the Kohn-Sham derivative matrix within density functional perturbation theory
Hu, Chunping, Tsukagoshi, Takayuki, Sugino, Osamu, Watanabe, KazuyukiVolume:
87
Language:
english
Journal:
Physical Review B
DOI:
10.1103/PhysRevB.87.035421
Date:
January, 2013
File:
PDF, 291 KB
english, 2013