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Computer simulations of dense molecular fluids

โœ Scribed by Steele, William A.; Streett, William B.


Book ID
121260347
Publisher
Taylor and Francis Group
Year
1980
Tongue
English
Weight
582 KB
Volume
39
Category
Article
ISSN
0026-8976

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Non-equilibrium molecular dynamics simul
โœ A.D. Simmsons; P.T. Cummings ๐Ÿ“‚ Article ๐Ÿ“… 1986 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 603 KB

We present a non-equilibrium molecular dynamics simulation of 125 methane molecules using a variant of the isokinetic "sllod" algorithm. The shear viscosity, pressure and internal energy of methane in a dense, supercritical fluid state (temperature 285.7 K and mass density 0.288 g/cm3) are calculate