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Monte Carlo liquid water simulations with four-body interactions included

โœ Scribed by J. Detrich G. Corongiu; E. Clementi

Book ID
104581432
Publisher
John Wiley and Sons
Year
1984
Tongue
English
Weight
411 KB
Volume
26
Category
Article
ISSN
0020-7608

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Monte Carlo liquid water simulation with
Monte Carlo liquid water simulation with four-body interactions included
โœ J. Detrich; G. Corongiu; E. Clementi ๐Ÿ“‚ Article ๐Ÿ“… 1984 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 388 KB

for water molecules is derived. The new terms are combined with previously dcvclopcd two-and three-body POtCntht tcrrnsond upplied in n hlctropolis-Monte Carlo simulation at 298 K for nn (N, I',?") ensemble with 513 water molecules. Improvements, relative to the results using only two-body, or two-a