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Calculations of the thermodynamic properties of diatomic fluids with the use of multiparticle intermolecular interaction potentials

✍ Scribed by S. G. D’yakonov; A. V. Klinov; V. V. Nikeshin; A. V. Malygin

Book ID
110183155
Publisher
International Academic Publishing Co (Nauka/Interperiodica)
Year
2006
Tongue
English
Weight
167 KB
Volume
80
Category
Article
ISSN
0036-0244

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## Abstract Intermolecular interaction energy data for the methane dimer have been calculated at a spectroscopic accuracy and employed to construct an __ab initio__ potential energy surface (PES) for molecular dynamics (MD) simulations of fluid methane properties. The full potential curves of the m