SCOPUS 정보 검색 플랫폼

Volumn 133, Issue 13, 2010, Pages

Efficient calculation of temperature dependence of solid-phase free energies by overlap sampling coupled with harmonically targeted perturbation

(3) Tan, Tai Boon a Schultz, Andrew J a Kofke, David A a

a State University of New York (United States)

Author keywords

[No Author keywords available]

Indexed keywords

BODY-CENTERED CUBIC; CALCULATION OF TEMPERATURE; CRYSTALLINE SOLIDS; FACE-CENTERED CUBIC; FCC STRUCTURES; FREE ENERGY PERTURBATION; FREE-ENERGY DIFFERENCE; HARMONIC MODEL; HARMONIC SYSTEM; HEXAGONAL CLOSE PACKING; MELTING CONDITIONS; NEAR-ZERO TEMPERATURE; SOFT POTENTIALS; SOLID-PHASE; TEMPERATURE CHANGES; TEMPERATURE PERTURBATIONS;

CRYSTAL STRUCTURE; FREE ENERGY; HARMONIC ANALYSIS; HTTP; MELTING; THERMODYNAMIC STABILITY;

TEMPERATURE;

EID: 79955701338 PISSN: 00219606 EISSN: None Source Type: Journal
DOI: 10.1063/1.3483899 Document Type: Article

Times cited : (24)

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