The molecular dynamics of CH2CI 2 in the liquid state have been simulated with two model representations of the intermolecular potential. These consist of a 3 x 3 and 5 x 5 atom-atom simulation with or without fractional charges at the atomic sites. A variety of thermodynamical and spectroscopic r
Molecular dynamics computer simulation of liquid dichloromethane. I. Equilibrium properties
β Scribed by Mauro Ferrario; Myron W. Evans
- Publisher
- Elsevier Science
- Year
- 1982
- Tongue
- English
- Weight
- 421 KB
- Volume
- 72
- Category
- Article
- ISSN
- 0301-0104
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