Open AccessCar-Parrinello Simulation of Water at Supercritical Conditions
Author(s) -
Mauro Boero,
Kiyoyuki Terakura,
Tamio Ikeshoji,
Chee Chin Liew,
Michele Parrinello
Publication year - 2000
Publication title -
progress of theoretical physics supplement
Language(s) - English
Resource type - Journals
ISSN - 0375-9687
DOI - 10.1143/ptps.138.259
Subject(s) - supercritical fluid , molecular dynamics , dipole , trimer , moment (physics) , chemical physics , character (mathematics) , dimer , molecule , cluster (spacecraft) , water dimer , materials science , computational chemistry , chemistry , molecular physics , physics , thermodynamics , hydrogen bond , classical mechanics , computer science , geometry , organic chemistry , mathematics , programming language
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