Development of a “First Principles” Water Potential with Flexible Monomers: Dimer Potential Energy Surface, VRT Spectrum, and Second Virial Coefficient

Title
Development of a “First Principles” Water Potential with Flexible Monomers: Dimer Potential Energy Surface, VRT Spectrum, and Second Virial Coefficient
Authors
Keywords
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Journal
Journal of Chemical Theory and Computation
Volume 9, Issue 12, Pages 5395-5403
Publisher
American Chemical Society (ACS)
Online
2013-11-15
DOI
10.1021/ct400863t

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