๐”– Bobbio Scriptorium
โœฆ   LIBER   โœฆ

Computer simulation of molecular liquids

โœ Scribed by A. Bellemans

Publisher
Elsevier Science
Year
1982
Weight
254 KB
Volume
24
Category
Article
ISSN
0378-4487

No coin nor oath required. For personal study only.

โœฆ Synopsis

The usefulness of computer simulations of dense polyatomic fluids is asserted and illustrated by means of several examples (especially rotation-translation couplinq and conformational transitions in alcanes). Technical points and present trends in simulations are discussed as well.

๐Ÿ“œ SIMILAR VOLUMES

Computer simulation of the molecular dyn
Computer simulation of the molecular dynamics of liquid dichloro methane
โœ M.W. Evans; M. Ferrario ๐Ÿ“‚ Article ๐Ÿ“… 1982 ๐Ÿ› Elsevier Science โš– 871 KB

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

Decoupling effects in computer simulatio
Decoupling effects in computer simulation of liquid-state molecular dynamics
โœ Myron W. Evans; Paolo Grigolini; Fabio Marchesoni ๐Ÿ“‚ Article ๐Ÿ“… 1983 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 329 KB

D~cout~lin;: effects in liquid-state molecular dynamics are unambiguously proven by computer simulationr These can be describ~ul ;is tbc we&c=ninS of the dissipnrivc interaction between the system of interest (e.g. molecular angular veloci-IF) rrnd its 11wr1nrrI barb caused by an intense external fi