Accurate dipole polarizabilities for water clusters n=2–12 at the coupled-cluster level of theory and benchmarking of various density functionals
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.3263604
Reference114 articles.
1. ‘‘Ab initio’’ liquid water
2. Comparison of simple potential functions for simulating liquid water
3. Ab initio molecular dynamics using hybrid density functionals
4. Development of transferable interaction models for water. I. Prominent features of the water dimer potential energy surface
5. Development of transferable interaction models for water. II. Accurate energetics of the first few water clusters from first principles
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