A hybrid-basis close-coupling interface to quantum chemistry packages for the treatment of ionization problems
Marante, Carlos, Klinker, Markus, Corral, Inés, Gonzalez-Vazquez, Jesus, Argenti, Luca, Martin, FernandoLanguage:
english
Journal:
Journal of Chemical Theory and Computation
DOI:
10.1021/acs.jctc.6b00907
Date:
December, 2016
File:
PDF, 810 KB
english, 2016