Time-Dependent Density Functional Tight Binding: New Formulation and Benchmark of Excited States
Trani, Fabio, Scalmani, Giovanni, Zheng, Guishan, Carnimeo, Ivan, Frisch, Michael J., Barone, VincenzoVolume:
7
Language:
english
Journal:
Journal of Chemical Theory and Computation
DOI:
10.1021/ct200461y
Date:
October, 2011
File:
PDF, 1.22 MB
english, 2011