A simple model for the intermolecular potential of water
โ Scribed by Bratko, D.; Blum, L.; Luzar, A.
- Book ID
- 119964214
- Publisher
- American Institute of Physics
- Year
- 1985
- Tongue
- English
- Weight
- 613 KB
- Volume
- 83
- Category
- Article
- ISSN
- 0021-9606
- DOI
- 10.1063/1.449585
No coin nor oath required. For personal study only.
๐ SIMILAR VOLUMES
An empirical intermolecular potential energy function with two adjustable parameters is proposed for quasi-spherical, non-polar molecules. Calculation of the second virial coefficients of methane, xenon and fluoromethane shows that the model is comparable with three-parameter potential functions.
An intermolecular potential model for hydrogen fluoride is proposed. This has a central Lennard-Jones part, three axial charges fixed by the dipole and quadrupole moments, and anisotropic polarizability. Good agreement with experimental values is found for the dimer, liquid and crystal lattice struc