Addressing the Issues of Non-isotropy and Non-additivity in the Development of Quantum Chemistry-Grounded Polarizable Molecular Mechanics.

Autor: Gresh, Nohad, Hage, Krystel El, Goldwaser, Elodie, de Courcy, Benoit, Chaudret, Robin, Perahia, David, Narth, Christophe, Lagardère, Louis, Lipparini, Filippo, Piquemal, Jean-Philip
Zdroj: Quantum Modeling of Complex Molecular Systems; 2015, p1-49, 49p
Databáze: Complementary Index