Open AccessBulk Properties of Liquids and Molecular Properties in Liquids from a Combination of Quantum Chemical Calculations and Classical Simulations
Author(s) -
Hanspeter Huber,
Елена Ермакова,
Jan Solca,
Gerold Steinebrunner
Publication year - 1996
Publication title -
chimia
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 0.387
H-Index - 55
eISSN - 2673-2424
pISSN - 0009-4293
DOI - 10.2533/chimia.1996.27
Subject(s) - quantum chemical , quantum , statistical physics , molecular dynamics , physics , chemical physics , computational chemistry , materials science , chemistry , quantum mechanics , molecule