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This content will become publicly available on December 26, 2018

Title: Temperature-dependent vibrational spectra and structure of liquid water from classical and quantum simulations with the MB-pol potential energy function

Authors:
ORCiD logo [1] ; ORCiD logo [1] ; ORCiD logo [1] ;  [2]
  1. Department of Chemistry and Biochemistry, University of California San Diego, La Jolla, California 92093, USA
  2. Department of Chemistry and Biochemistry, Materials Science and Engineering, and San Diego Supercomputer Center, University of California San Diego, La Jolla, California 92093, USA
Publication Date:
Grant/Contract Number:
DEAC02-05CH11231
Type:
Publisher's Accepted Manuscript
Journal Name:
Journal of Chemical Physics
Additional Journal Information:
Journal Volume: 147; Journal Issue: 24; Related Information: CHORUS Timestamp: 2018-02-14 10:21:01; Journal ID: ISSN 0021-9606
Publisher:
American Institute of Physics
Sponsoring Org:
USDOE
Country of Publication:
United States
Language:
English
OSTI Identifier:
1414871