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Proton Transfer 200 Years after von Grotthuss: Insights from Ab Initio Simulations
Author(s) -
Marx Dominik
Publication year - 2007
Publication title -
chemphyschem
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 1.016
H-Index - 140
eISSN - 1439-7641
pISSN - 1439-4235
DOI - 10.1002/cphc.200790002
Subject(s) - ab initio , chemistry , proton , molecular dynamics , ab initio quantum chemistry methods , physics , computational chemistry , molecule , quantum mechanics