Universal tight binding model for chemical reactions in solution and at surfaces. II. Water
Author:
Affiliation:
1. Atomistic Simulation Centre, School of Mathematics and Physics, Queen's University Belfast, Belfast BT7 1NN, Northern Ireland, United Kingdom
2. Department of Physics, King's College London, Strand, London WC2R 2LS, United Kingdom
Funder
Engineering and Physical Sciences Research Council (EPSRC)
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.4890343
Reference65 articles.
1. Universal tight binding model for chemical reactions in solution and at surfaces. I. Organic molecules
2. Bulk Liquid Water at Ambient Temperature and Pressure from MP2 Theory
3. Water Molecule Dipole in the Gas and in the Liquid Phase
4. The missing term in effective pair potentials
5. Comparison of simple potential functions for simulating liquid water
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