Pair potential for water from symmetry-adapted perturbation theory
- 15 September 1997
- journal article
- Published by AIP Publishing in The Journal of Chemical Physics
- Vol. 107 (11) , 4207-4218
- https://doi.org/10.1063/1.474795
Abstract
No abstract availableKeywords
This publication has 54 references indexed in Scilit:
- Symmetry-adapted perturbation theory applied to interaction-induced properties of collisional complexesMolecular Physics, 1996
- Effects of monomer geometry and basis set saturation on computed depth of water dimer potentialThe Journal of Chemical Physics, 1996
- Symmetry-adapted perturbation theory of nonadditive three-body interactions in van der Waals molecules. I. General theoryThe Journal of Chemical Physics, 1995
- Many-body perturbation theory of frequency-dependent polarizabilities and van der Waals coefficients: Application to H2O–H2O and Ar–NH3The Journal of Chemical Physics, 1992
- High-quality Gaussian basis sets for fourth-row atomsTheoretical Chemistry Accounts, 1992
- Potential energy surface for dispersion interaction in water dimer and hydrogen fluoride dimerThe Journal of Physical Chemistry, 1990
- Computation of the short range repulsion energy from correlated monomer wavefunctions in van der Waals dimers containing He, Ne, and N2Molecular Physics, 1989
- Experimental densities and virial coefficients for steam from 348 to 498 K with correction for adsorption effectsThe Journal of Chemical Thermodynamics, 1988
- On the connection between the supermolecular Møller-Plesset treatment of the interaction energy and the perturbation theory of intermolecular forcesMolecular Physics, 1988
- Comparison of simple potential functions for simulating liquid waterThe Journal of Chemical Physics, 1983