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A reappraisal of what we have learnt during three decades of computer simulations on water

Journal of Molecular Liquids · 2002 · Vol. 101(1-3) · pp. 219–260
B. Guillot
Spectroscopy and Quantum Chemical StudiesQuantum, superfluid, helium dynamicsAdvanced Thermodynamics and Statistical MechanicsField (mathematics)Liquid waterKey (lock)Computer sciencePoint (geometry)Data scienceEnvironmental scienceEarth scienceGeologyMathematics
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References
Comparison of simple potential functions for simulating liquid water
The Journal of Chemical Physics · 1983 · 41,376 citations
Empirical potential Monte Carlo simulation of fluid structure
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New perspectives on hydrophobic effects
Chemical Physics · 2000 · 307 citations
Unified Approach for Molecular Dynamics and Density-Functional Theory
Physical Review Letters · 1985 · 10,613 citations
The missing term in effective pair potentials
The Journal of Physical Chemistry · 1987 · 13,192 citations
A molecular dynamics study of polarizable water
Molecular Physics · 1989 · 410 citations
Equation of State Calculations by Fast Computing Machines
The Journal of Chemical Physics · 1953 · 36,613 citations
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