Well-behaved coarse-grained model of density-functional theory
نویسندگان
چکیده
منابع مشابه
Classical density functional theory & simulations on a coarse-grained model of aromatic ionic liquids.
A new classical density functional approach is developed to accurately treat a coarse-grained model of room temperature aromatic ionic liquids. Our major innovation is the introduction of charge-charge correlations, which are treated in a simple phenomenological way. We test this theory on a generic coarse-grained model for aromatic RTILs with oligomeric forms for both cations and anions, appro...
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ژورنال
عنوان ژورنال: Physical Review A
سال: 2010
ISSN: 1050-2947,1094-1622
DOI: 10.1103/physreva.82.012109