Extraction of effective solid-liquid interfacial free energies for full 3D solid crystallites from equilibrium MD simulations
Author(s) -
Luis A. Zepeda-Ruiz,
Babak Sadigh,
A. A. Chernov,
Tomorr Haxhimali,
Amit Samanta,
Tomas Oppelstrup,
Sébastien Hamel,
Lorin X. Benedict,
Jonathan L. Belof
Publication year - 2017
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 - 10.1063/1.4997595
Subject(s) - crystallite , molecular dynamics , materials science , isotropy , context (archaeology) , flattening , thermodynamics , chemistry , physics , computational chemistry , composite material , metallurgy , paleontology , quantum mechanics , biology
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