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Multilayer adsorption by Monte Carlo simulation

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Multilayer adsorption by Monte Carlo simulation

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dc.contributor.author Molina Mateo, José es_ES
dc.contributor.author Salmerón Sánchez, Manuel es_ES
dc.contributor.author Monleón Pradas, Manuel es_ES
dc.contributor.author Torregrosa Cabanilles, Constantino es_ES
dc.date.accessioned 2018-06-23T04:22:19Z
dc.date.available 2018-06-23T04:22:19Z
dc.date.issued 2012 es_ES
dc.identifier.issn 0378-4371 es_ES
dc.identifier.uri http://hdl.handle.net/10251/104546
dc.description.abstract [EN] Adsorption phenomena are characterized by models that include free parameters trying to reproduce experimental results. In order to understand the relationship between the model parameters and the material properties, the adsorption of small molecules on a crystalline plane surface has been simulated using the bond fluctuation model. A direct comparison between the Guggenheim-Anderson-de Boer (GAB) model for multilayer adsorption and computer simulations allowed us to establish correlations between the adsorption model parameters and the simulated interaction potentials. © 2012 Elsevier B.V. All rights reserved. es_ES
dc.description.sponsorship The authors would like to acknowledge the support provided by the Conselleria d'Educacio of the Generalitat Valenciana through the GV/2009/033 project. en_EN
dc.language Inglés es_ES
dc.publisher Elsevier es_ES
dc.relation GENERALITAT VALENCIANA/GV/2009/033 es_ES
dc.relation.ispartof Physica A Statistical Mechanics and its Applications es_ES
dc.rights Reserva de todos los derechos es_ES
dc.subject Bond Fluctuation Model es_ES
dc.subject Multilayer adsorption es_ES
dc.subject Adsorption model es_ES
dc.subject Adsorption phenomena es_ES
dc.subject Crystalline planes es_ES
dc.subject Free parameters es_ES
dc.subject Interaction potentials es_ES
dc.subject Material property es_ES
dc.subject Model parameters es_ES
dc.subject Monte Carlo Simulation es_ES
dc.subject Small molecules es_ES
dc.subject Adsorption es_ES
dc.subject Monte Carlo methods es_ES
dc.subject Multilayers es_ES
dc.subject Computer simulation es_ES
dc.subject.classification FISICA APLICADA es_ES
dc.subject.classification MAQUINAS Y MOTORES TERMICOS es_ES
dc.title Multilayer adsorption by Monte Carlo simulation es_ES
dc.type Artículo es_ES
dc.identifier.doi 10.1016/j.physa.2012.05.016 es_ES
dc.rights.accessRights Abierto es_ES
dc.contributor.affiliation Universitat Politècnica de València. Departamento de Física Aplicada - Departament de Física Aplicada es_ES
dc.contributor.affiliation Universitat Politècnica de València. Departamento de Termodinámica Aplicada - Departament de Termodinàmica Aplicada es_ES
dc.description.bibliographicCitation Molina Mateo, J.; Salmerón Sánchez, M.; Monleón Pradas, M.; Torregrosa Cabanilles, C. (2012). Multilayer adsorption by Monte Carlo simulation. Physica A Statistical Mechanics and its Applications. 391(20):4474-4782. doi:10.1016/j.physa.2012.05.016 es_ES
dc.description.accrualMethod S es_ES
dc.relation.publisherversion https://doi.org/10.1016/j.physa.2012.05.016 es_ES
dc.description.upvformatpinicio 4474 es_ES
dc.description.upvformatpfin 4782 es_ES
dc.type.version info:eu-repo/semantics/publishedVersion es_ES
dc.description.volume 391 es_ES
dc.description.issue 20 es_ES
dc.relation.pasarela 229957 es_ES
dc.contributor.funder GENERALITAT VALENCIANA es_ES


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