Monte Carlo simulation results for pure liquid acetone and water-acetone mixtures calculated in the isothermal and isobaric (NPT) ensemble at T=298K and p=l.0atm are presented. The TIP4P model was used for water and optimized potential for liquid simulation (OPLS) force field parameters used for ace
β¦ LIBER β¦
Liquid-liquid phase transitions in supercooled water studied by computer simulations of various water models
β Scribed by Brovchenko, Ivan; Geiger, Alfons; Oleinikova, Alla
- Book ID
- 121506425
- Publisher
- American Institute of Physics
- Year
- 2005
- Tongue
- English
- Weight
- 514 KB
- Volume
- 123
- Category
- Article
- ISSN
- 0021-9606
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