A Quantitative Assessment of the Accuracy of Centroid Molecular Dynamics for the Calculation of the Infrared Spectrum of Liquid Water

TitleA Quantitative Assessment of the Accuracy of Centroid Molecular Dynamics for the Calculation of the Infrared Spectrum of Liquid Water
Publication TypeJournal Article
Year of Publication2010
AuthorsPaesani, F, Voth, GA
JournalJ. Chem. Phys.
Volume132
Pagination014105
DOI10.1063/1.3291212