Canonical monte carlo simulation of adsorption of O2 and N 2 mixture on single walled carbon nanotube at different temperatures and pressures

Journal of Computational Chemistry

Volumn 31, Issue 7, 2010, Pages 1443-1449

  Rafati, Amir Abbas ^a   Hashemianzadeh, Sayed Majid ^b   Nojini, Zabiollah Bolboli ^a   Naghshineh, Negin ^b  

^a BU ALI SINA UNIVERSITY   (Iran)

^b IRAN UNIVERSITY OF SCIENCE AND TECHNOLOGY   (Iran)

Author keywords

Adsorption isotherm; Gas adsorption; Lennard Jones potential; Molecular simulation; Single walled carbon nanotube

Indexed keywords

ADSORBATE STRUCTURES; ADSORPTION MEASUREMENT; AMBIENT CONDITIONS; CANONICAL MONTE CARLO; COMPARATIVE STUDIES; IDENTICAL CONDITIONS; INNER SURFACES; LANGMUIRS; LENNARD-JONES POTENTIAL; MOLECULAR SIMULATION; MOLECULAR SIMULATIONS; MONTE CARLO SIMULATION; OUTER SURFACE; PRESSURE RANGES; SOLID-FLUID INTERACTIONS; STORAGE CAPACITY; SUPER-CRITICAL;

ADSORPTION ISOTHERMS; CARBON NANOTUBES; COMPUTER SIMULATION; GAS ADSORPTION; GASES; MIXTURES; MOLECULAR STRUCTURE; MONTE CARLO METHODS;

SINGLE-WALLED CARBON NANOTUBES (SWCN);

EID: 77950873909     PISSN: 01928651     EISSN: 1096987X     Source Type: Journal    
DOI: 10.1002/jcc.21428     Document Type: Article

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