Multipole moments for embedding potentials: Exploring different atomic allocation algorithms
S. Nørby, Morten, Magnus Haugaard Olsen, Jógvan, Kongsted, Jacob, Aagard Jensen, Hans JørgenVolume:
37
Language:
english
Journal:
Journal of Computational Chemistry
DOI:
10.1002/jcc.24403
Date:
July, 2016
File:
PDF, 590 KB
english, 2016