| Literature DB >> 23298242 |
Scott Habershon1, David E Manolopoulos, Thomas E Markland, Thomas F Miller.
Abstract
This article reviews the ring-polymer molecular dynamics model for condensed-phase quantum dynamics. This model, which involves classical evolution in an extended ring-polymer phase space, provides a practical approach to approximating the effects of quantum fluctuations on the dynamics of condensed-phase systems. The review covers the theory, implementation, applications, and limitations of the approximation.Entities:
Year: 2013 PMID: 23298242 DOI: 10.1146/annurev-physchem-040412-110122
Source DB: PubMed Journal: Annu Rev Phys Chem ISSN: 0066-426X Impact factor: 12.703