Model dependence of quantum isotope effects in liquid water
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.460823
Reference26 articles.
1. Theory and Molecular Models for Water
2. Improved simulation of liquid water by molecular dynamics
3. Comparison of simple potential functions for simulating liquid water
4. Exploiting the isomorphism between quantum theory and classical statistical mechanics of polyatomic fluids
5. A quantum mechanical study of structure in liquid H2O and D2O
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