Combination of a Voronoi-type Complex Absorbing Potential with the XMS-CASPT2 Method and Pilot Applications
Phung, Quan Manh, Komori, Yuki, Yanai, Takeshi, Sommerfeld, Thomas, Ehara, MasahiroLanguage:
english
Journal:
Journal of Chemical Theory and Computation
DOI:
10.1021/acs.jctc.9b01032
Date:
February, 2020
File:
PDF, 3.01 MB
english, 2020