Integral Equation Theory of Molecular Solvation Coupled with Quantum Mechanical/Molecular Mechanics Method in NWChem Package
Chuev, Gennady N., Valiev, Marat, Fedotova, Marina V.Volume:
8
Language:
english
Journal:
Journal of Chemical Theory and Computation
DOI:
10.1021/ct2009297
Date:
April, 2012
File:
PDF, 1.45 MB
english, 2012