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dc.contributor | Universitat Politècnica de Catalunya. Departament de Física i Enginyeria Nuclear |
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dc.contributor | Universitat Politècnica de Catalunya. SIMCON - Grup de Recerca de Simulació per Ordinador en Matèria Condensada |
dc.contributor.author | Guàrdia Manuel, Elvira |
dc.contributor.author | Skarmoutsos, Ioannis |
dc.contributor.author | Masia, Marco |
dc.date | 2015-07-23 |
dc.identifier.citation | Guardia, E., Skarmoutsos, I., Masia, M. Hydrogen bonding and related properties in liquid water: a Car-Parrinello molecular dynamics simulation study. "Journal of physical chemistry B", 23 Juliol 2015, núm. 29, p. 8926-8938. |
dc.identifier.citation | 1520-6106 |
dc.identifier.citation | 10.1021/jp507196q |
dc.identifier.uri | http://hdl.handle.net/2117/76835 |
dc.language.iso | eng |
dc.rights | info:eu-repo/semantics/openAccess |
dc.rights | http://creativecommons.org/licenses/by-nc-nd/3.0/es/ |
dc.subject | Àrees temàtiques de la UPC::Física |
dc.subject | Hydrogen bonding |
dc.subject | Water |
dc.subject | LOW-FREQUENCY SPECTRUM |
dc.subject | NORMAL-MODE ANALYSIS |
dc.subject | 1ST PRINCIPLES |
dc.subject | VIBRATIONAL-SPECTRUM |
dc.subject | DENSITY |
dc.subject | REORIENTATION |
dc.subject | SPECTROSCOPY |
dc.subject | MECHANISM |
dc.subject | CONSTANTS |
dc.subject | DIFFUSION |
dc.subject | Enllaços d'hidrogen |
dc.subject | Aigua |
dc.title | Hydrogen bonding and related properties in liquid water: a Car-Parrinello molecular dynamics simulation study |
dc.type | info:eu-repo/semantics/submittedVersion |
dc.type | info:eu-repo/semantics/article |
dc.description.abstract | |
dc.description.abstract |