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Journal of Molecular Modeling

Volumn 17, Issue 4, 2011, Pages 811-816

Molecular simulations of intermediate and long alkanes adsorbed on graphite: Tuning of non-bond interactions

(4) Firlej, Lucyna a,d Kuchta, Bogdan a,c Roth, Michael W b Wexler, Carlos a

a UNIVERSITY OF MISSOURI (United States)

b UNIVERSITY OF NORTHERN IOWA (United States)

c AIX MARSEILLE UNIVERSITY (France)

d UNIV MONTPELLIER (France)

Author keywords

Alkanes on graphite; Long molecules on graphite; Molecular dynamics; Scaling of CHARMM parameters; Surface phase transitions

Indexed keywords

ALKANE; GRAPHITE;

ADSORPTION; ARTICLE; CHEMICAL INTERACTION; CHEMICAL STRUCTURE; MELTING POINT; MOLECULAR DYNAMICS; PHASE TRANSITION; PRIORITY JOURNAL; SIMULATION; TEMPERATURE;

ADSORPTION; ALKANES; GRAPHITE; MOLECULAR DYNAMICS SIMULATION; PHASE TRANSITION; SURFACE PROPERTIES; TEMPERATURE;

EID: 79958129106 PISSN: 16102940 EISSN: 09485023 Source Type: Journal
DOI: 10.1007/s00894-010-0770-0 Document Type: Article

Times cited : (10)

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* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.