Open AccessThermophysical properties of water using reactive force fields
Author(s) -
Oliver R. Gittus,
Fernando Bresme
Publication year - 2021
Publication title -
the journal of chemical physics
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 1.071
H-Index - 357
eISSN - 1089-7690
pISSN - 0021-9606
DOI - 10.1063/5.0057868
Subject(s) - water model , reaxff , chemistry , isobar , force field (fiction) , dipole , quadrupole , properties of water , molecular dynamics , thermodynamics , chemical physics , computational chemistry , interatomic potential , physics , atomic physics , organic chemistry , nucleon , quantum mechanics
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