Classical density functional theory code
Project description
CDFTPY: Python package for performing classical denisty functional theory calculations for molecular liquids
Marat Valiev and Gennady Chuev
References:
Gennady N Chuev, Marina V Fedotova and Marat Valiev, Renormalized site density functional theory, J. Stat. Mech. (2021) 033205
Chuev GN, Fedotova MV, Valiev M. Chemical bond effects in classical site density functional theory of inhomogeneous molecular liquids. J Chem Phys. 2020 Jan 31;152(4):041101. doi: 10.1063/1.5139619. PMID: 32007044.
Marat Valiev and Gennady N Chuev, Site density models of inhomogeneous classical molecular liquids, J. Stat. Mech. (2018) 093201
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