Computer simulation of the atomic behaviour in condensed phases.

Giró Roca, Antoni, and Padró, Joan Angel. "Computer simulation of the atomic behaviour in condensed phases.." Qüestiió 11.2 (1987): 65-79. <http://eudml.org/doc/40107>.

@article{GiróRoca1987,
abstract = {Molecular dynamics simulation method for the study of condensed phases of matter is described in this paper. Computer programs for the simulation of atomic motion have been developed. Time-saving techniques, like the cellular method have been incorporated in order to optimize the available computer resources. We have applied this method to the simulation of Argon near its melting point. Differences in the structure, thermodynamic properties and time correlation functions of solid and liquid phases are discussed.},
author = {Giró Roca, Antoni, Padró, Joan Angel},
journal = {Qüestiió},
keywords = {Dinámica molecular; Simulación por ordenador; Aplicaciones; Fase sólida; Fase líquida; Estructura molecular; computer simulation; molecular dynamics; statistical mechanics; condensed matter; structural-properties; thermodynamic properties; transport properties},
language = {eng},
number = {2},
pages = {65-79},
title = {Computer simulation of the atomic behaviour in condensed phases.},
url = {http://eudml.org/doc/40107},
volume = {11},
year = {1987},
}

TY - JOUR
AU - Giró Roca, Antoni
AU - Padró, Joan Angel
TI - Computer simulation of the atomic behaviour in condensed phases.
JO - Qüestiió
PY - 1987
VL - 11
IS - 2
SP - 65
EP - 79
AB - Molecular dynamics simulation method for the study of condensed phases of matter is described in this paper. Computer programs for the simulation of atomic motion have been developed. Time-saving techniques, like the cellular method have been incorporated in order to optimize the available computer resources. We have applied this method to the simulation of Argon near its melting point. Differences in the structure, thermodynamic properties and time correlation functions of solid and liquid phases are discussed.
LA - eng
KW - Dinámica molecular; Simulación por ordenador; Aplicaciones; Fase sólida; Fase líquida; Estructura molecular; computer simulation; molecular dynamics; statistical mechanics; condensed matter; structural-properties; thermodynamic properties; transport properties
UR - http://eudml.org/doc/40107
ER -