Development of a “First-Principles” Water Potential with Flexible Monomers. III. Liquid Phase Properties
Author:
Affiliation:
1. Department of Chemistry and Biochemistry, University of California, San Diego, La Jolla, California 92093, United States
Funder
Division of Chemistry
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry,Computer Science Applications
Link
https://pubs.acs.org/doi/pdf/10.1021/ct5004115
Reference67 articles.
1. Unified Approach for Molecular Dynamics and Density-Functional Theory
2. The variational explicit polarization potential and analytical first derivative of energy: Towards a next generation force field
3. Chapter 10 The Effective Fragment Potential: A General Method for Predicting Intermolecular Interactions
4. Self-consistent polarization neglect of diatomic differential overlap: Application to water clusters
5. Semiempirical Self-Consistent Polarization Description of Bulk Water, the Liquid−Vapor Interface, and Cubic Ice
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