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Adsorption of Hydrogen Molecules on Carbon Nanotubes Using Quantum Chemistry and Molecular Dynamics

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dc.contributor.affiliation"Dipartimento di Chimica, Biologia e Biotecnologie, Università degli Studi di Perugia, Via Elce di Sotto 8, Perugia, 06123, Italy"," Chemical Physics Department, Institute for Theoretical and Computational Chemistry (IQTUB), Universitat de Barcelona, Martí i Franqués 1, Barcelona, 08028, Spain"," Departamento de Química, Universidad Autónoma de Madrid, Módulo 13, Madrid, 28049, Spain"," Instituto Madrileño de Estudios Avanzados en Nanociencia (IMDEA-Nanociencia), Cantoblanco, Madrid, 28049, Spain"," Condensed Matter Physics Center (IFIMAC), Universidad Autónoma de Madrid, Madrid, 28049, Spain"en
dc.contributor.affiliation000000041762408X
dc.contributor.authorFaginas-Lago N.
dc.contributor.authorYeni D.
dc.contributor.authorHuarte F.
dc.contributor.authorWang Y.
dc.contributor.authorAlcamí M.
dc.contributor.authorMartín, Fernando
dc.date.accessioned2020-12-04T11:12:03Z
dc.date.available2020-12-04T11:12:03Z
dc.date.issued2016
dc.identifier.doi10.1021/acs.jpca.5b12574en
dc.identifier.urihttp://hdl.handle.net/20.500.12614/416
dc.journal.titleJournal of Physical Chemistry Aen
dc.language.isoenen
dc.page.initial6451en
dc.relation.projectIDTEMPWork also supported by the MINECO projects FIS2013-42001-R, CTQ2013-41307-P and CTQ2013-43698-P, the CAM project NANOFRONTMAGCM (ref S2013/MIT-2850), the MINECO project FUNCGRAPHENE (ref FIS2013-40667-P) and the European COST Action CM1204 XLIC.
dc.rightsAtribución-NoComercial-SinDerivadas 3.0 España*
dc.rights.accessRightsopen accessen
dc.rights.urihttp://creativecommons.org/licenses/by-nc-nd/3.0/es/*
dc.titleAdsorption of Hydrogen Molecules on Carbon Nanotubes Using Quantum Chemistry and Molecular Dynamicsen
dc.typeresearch articleen
dc.volume.number120en
dspace.entity.typePublication

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