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Unraveling Interactions in Molecular Crystals Using Dispersion Corrected Density Functional Theory: The Case of the Epoxydihydroarsanthrene Molecules
dc.contributor.author | Otero de la Roza, Alberto | |
dc.contributor.author | Luaña Cabal, Víctor | |
dc.contributor.author | Tiekink, Edward R. T. | |
dc.contributor.author | Zukerman Schpector, Julio | |
dc.date.accessioned | 2015-03-20T12:41:46Z | |
dc.date.available | 2015-03-20T12:41:46Z | |
dc.date.issued | 2014 | |
dc.identifier.citation | Journal of Chemical Theory And Computation, 10(11), p. 5010-5019 (2014); doi:10.1021/ct500832g | |
dc.identifier.issn | 1549-9618 | |
dc.identifier.issn | 1549-9626 | |
dc.identifier.uri | http://hdl.handle.net/10651/30447 | |
dc.description.sponsorship | Spanish Malta/Consolider initiative [CSD2007-00045]; Spanish MINECO [CTQ2012-31174]; Ministry of Higher Education, Malaysia [UM.C/625/1/HIR/MoE/SC/-03, UM.C/625/1/HIR/MoE/SC/-12]; Brazilian agency CNPq [305626/20132] | |
dc.format.extent | p. 5010-5019 | |
dc.language.iso | eng | |
dc.relation.ispartof | Journal Of Chemical Theory And Computation | |
dc.rights | © 2014 American Chemical Society | |
dc.source | WOS:000344905300025 | |
dc.title | Unraveling Interactions in Molecular Crystals Using Dispersion Corrected Density Functional Theory: The Case of the Epoxydihydroarsanthrene Molecules | |
dc.type | journal article | |
dc.identifier.doi | 10.1021/ct500832g | |
dc.relation.projectID | MINECO/CTQ2012-31174 | |
dc.relation.publisherversion | http://dx.doi.org/10.1021/ct500832g |
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