From classical to quantum and back: A Hamiltonian scheme for adaptive multi-resolution classical/path integral simulations
Kreis, Karsten, Tuckerman, Mark Edward, Donadio, Davide, Kremer, Kurt, Potestio, RaffaelloLanguage:
english
Journal:
Journal of Chemical Theory and Computation
DOI:
10.1021/acs.jctc.6b00242
Date:
May, 2016
File:
PDF, 2.14 MB
english, 2016