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dc.contributor.author | Bultinck, Patrick |
---|---|
dc.contributor.author | Alsenoy, Christian van |
dc.contributor.author | Ayers, Paul W. |
dc.contributor.author | Carbó-Dorca, Ramon |
dc.date | 2010-12-27T10:35:36Z |
dc.date | 2010-12-14T12:51:35Z |
dc.date | 2010-12-27T10:35:36Z |
dc.date | 2007 |
dc.identifier.citation | Bultinck, Patrick, Van Alsenoy, Christian, Ayers, Paul W., i Carbó-Dorca, Ramon (2007). Critical analysis and extension of the Hirshfeld atoms in molecules. Journal of Chemical Physics 126 (14), 144111. Recuperat 27 desembre 2010, a http://jcp.aip.org/resource/1/jcpsa6/v126/i14/p144111_s1 |
dc.identifier.citation | 0021-9606 (versió paper) |
dc.identifier.citation | 1089-7690 (versió electrònica) |
dc.identifier.uri | http://hdl.handle.net/10256/3198 |
dc.format | application/pdf |
dc.language.iso | eng |
dc.publisher | American Institute of Physics |
dc.relation | http://dx.doi.org/10.1063/1.2715563 |
dc.relation | Reproducció digital del document publicat a: http://dx.doi.org/10.1063/1.2715563 |
dc.relation | © Journal of Chemical Physics, 2007, vol. 126, núm. 14 |
dc.relation | Articles publicats (D-Q) |
dc.rights | Tots els drets reservats |
dc.rights | info:eu-repo/semantics/openAccess |
dc.subject | Dinàmica molecular |
dc.subject | Electrostàtica |
dc.subject | Enllaços químics |
dc.subject | Entropia |
dc.subject | Estructura electrònica |
dc.subject | Mètodes iteratius (Matemàtica) |
dc.subject | Chemical bonds |
dc.subject | Electronic structure |
dc.subject | Electrostatics |
dc.subject | Entropy |
dc.subject | Iterative methods |
dc.subject | Molecular dynamics |
dc.title | Critical analysis and extension of the Hirshfeld atoms in molecules |
dc.type | info:eu-repo/semantics/article |
dc.description.abstract |