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Molecular simulation of collection of methane isotherms in carbon material using all-atom and united atom models

LUCENA, Sebastião M. P1 ; FRUTUOSO, Luis F. A1 ; SILVINO, Pedro F. G1 ; AZEVEDO, Diana C. S1 ; TOSO, J. P2 ; ZGRABLICH, G2 ; CAVALCANTE, Célio L1
[1] Universidade Federal do Ceará, Dept. Eng. Química, Grupo de Pesquisa em Separações por Adsorção - GPSA, Campus do Pici, Bl. 709, 60455-760 Fortaleza, CE, Brazil
[2] Universidade Nacional de San Luis, Laboratorio de Ciencias de Superficies y Medios Porosos, Ejército de los Andes 950, 5700 San Luis, Argentina
Conference title
Characterization of Porous Materials: from Angstroms to Millimeters: A collection of Selected Papers presented at the Fifth International Workshop CPM-5, June 24-26, 2009, New Brunswick, New Jersey, USA
Conference name
International Workshop Characterization of Porous Materials: from Angstroms to Millimeters (CPM) (CPM) (5 ; New Brunswick, New Jersey 2009-06-24)
Author (monograph)
NEIMARK, Alexander V (Editor)1
[1] Department of Chemical and Biochemical Engineering Rutgers, The State University of New Jersey, 98 Brett Road, Piscataway, NJ 08854-8058, United States

Colloids and surfaces. A, Physicochemical and engineering aspects. 2010, Vol 357, Num 1-3, pp 53-60, 8 p ; ref : 23 ref

Scientific domain
Biochemistry, molecular biology, biophysics; General chemistry, physical chemistry; Nanotechnologies, nanostructures, nanoobjects; Polymers, paint and wood industries
Elsevier, Kidlington
Publication country
United Kingdom
Document type
Conference Paper
Author keyword
Activated carbon All-atom model Methane adsorption Monte Carlo simulations Pore size distribution
Keyword (fr)
Adsorption Caractérisation Carbone Charbon actif Dimension pore Distribution Donnée expérimentale Fluide Forme Graphite Isotherme adsorption Isotherme Matériau poreux Microporosité Modèle Méthane Méthode Monte Carlo Paramétrisation Pore Simulation Solide Structure interne
Keyword (en)
Adsorption Characterization Carbon Activated carbon Pore size Distribution Experimental data Fluid Shape Graphite Adsorption isotherm Isotherm Porous material Microporosity Models Methane Monte Carlo method Parameterization Pore Simulation Solid Internal structure
Keyword (es)
Adsorción Caracterización Carbono Carbón activado Dimensión poro Distribución Dato experimental Fluido Forma Grafito Isotermo adsorción Isoterma Material poroso Microporosidad Modelo Metano Método Monte Carlo Parametrización Poro Simulación Sólido Estructura interna
001 Exact sciences and technology / 001C Chemistry / 001C01 General and physical chemistry / 001C01I Surface physical chemistry / 001C01I06 Adsorbents

001 Exact sciences and technology / 001C Chemistry / 001C01 General and physical chemistry / 001C01J Colloidal state and disperse state / 001C01J08 Porous materials

General chemistry and physical chemistry
INIST identifier

Sauf mention contraire ci-dessus, le contenu de cette notice bibliographique peut être utilisé dans le cadre d’une licence CC BY 4.0 Inist-CNRS / Unless otherwise stated above, the content of this bibliographic record may be used under a CC BY 4.0 licence by Inist-CNRS / A menos que se haya señalado antes, el contenido de este registro bibliográfico puede ser utilizado al amparo de una licencia CC BY 4.0 Inist-CNRS

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