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Free Energy Calculations of Crystalline Hard Sphere Complexes Using Density Functional Theory

TitleFree Energy Calculations of Crystalline Hard Sphere Complexes Using Density Functional Theory
Publication TypeJournal Article
Year of Publication2015
AuthorsGunawardana, K, Song, XY
JournalJournal of Physical Chemistry B
Volume119
Pagination9160-9166
Date Published07
Type of ArticleArticle
ISBN Number1520-6106
Accession NumberWOS:000358623900038
Keywordsbinary-mixtures, entropy, fluid, fundamental measure-theory, liquid, simulation, stability, superlattice formation, transition, white bear version
Abstract

a reference system in perturbation calculations.

DOI10.1021/jp5090907
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Structures and Dynamics