Molecular modeling of porous carbons using the hybrid reverse Monte Carlo method

Langmuir

Volumn 22, Issue 24, 2006, Pages 9942-9948

  Jain, Surendra K ^a   Pellenq, Roland J M ^b   Pikunic, Jorge P ^c   Gubbins, Keith E ^a  

^a North Carolina State University   (United States)

^b AIX MARSEILLE UNIVERSITÉ   (France)

^c UNIVERSITY OF OXFORD   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

HYBRID REVERSE MONTE CARLO (HRMC); MOLECULAR MODELING; POROUS CARBONS; REVERSE MONTE CARLO (RMC) METHOD;

CORRELATION METHODS; FUNCTIONS; MATHEMATICAL MODELS; MONTE CARLO METHODS; POROUS MATERIALS; STATISTICAL METHODS;

CARBON;

CARBON; HYDROGEN; SUCROSE;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; COMPUTER SIMULATION; METHODOLOGY; MONTE CARLO METHOD; STATISTICAL MODEL; SURFACE PROPERTY; THEORETICAL MODEL; THERMODYNAMICS;

CARBON; CHEMISTRY; COMPUTER SIMULATION; HYDROGEN; MODELS, MOLECULAR; MODELS, STATISTICAL; MODELS, THEORETICAL; MONTE CARLO METHOD; SUCROSE; SURFACE PROPERTIES; THERMODYNAMICS;

EID: 33846125951     PISSN: 07437463     EISSN: None     Source Type: Journal    
DOI: 10.1021/la053402z     Document Type: Article

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