On the accurate calculation of the dielectric constant from molecular dynamics simulations: The case of SPC/E and SWM4-DP water

Chemical Physics Letters

Volumn 507, Issue 1-3, 2011, Pages 80-83

  Gereben, Orsolya ^a   Pusztai, László ^a  

^a INSTITUTE OF EXPERIMENTAL MEDICINE   (Hungary)

Author keywords

[No Author keywords available]

Indexed keywords

D-P MODEL; DIELECTRIC CONSTANTS; ISOTOPE EFFECT; LONG SIMULATION TIME; MOLECULAR DYNAMICS SIMULATIONS; POTENTIAL MODEL; SPC/E WATER; SYSTEM SIZE; TEMPERATURE DEPENDENCE; TRAJECTORY LENGTH; WATER MODELS;

ISOTOPES; MOLECULAR DYNAMICS;

COMPUTER SIMULATION;

EID: 79955480411     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2011.02.064     Document Type: Article

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