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Navegación por Agencia financiadora Danish Center for Scientific Computing
Mostrando resultados 1 a 8 de 8
| Derechos | Preview | Fecha Public. | Título | Autor(es) | Tipo |
| openAccess |  | 2010 | Ab initio vibrations in nonequilibrium nanowires | Jauho, Antti-Pekka; Engelund, Mads CSIC ORCID; Markussen, Troels; Brandbyge, Mads | artículo |
| closedAccess |  | 2018 | Analysis of the interactions in FCCF:(H2O) and FCCF:(H2O)2 complexes through the study of their indirect spin–spin coupling constants | Caputo, María Cristina; Alkorta, Ibon CSIC ORCID ; Provasi, Patricio F.; Sauer, Stephan P. A. | artículo |
| openAccess |  | 2009 | Atomistic theory for the damping of vibrational modes in monoatomic gold chains | Engelund, Mads CSIC ORCID; Brandbyge, Mads; Jauho, Antti-Pekka | artículo |
| closedAccess |  | 2015 | Design and performance characterization of electronic structure calculations on massively parallel supercomputers: a case study of GPAW on the Blue Gene/P architecture | Romero, N. A.; Larsen, Ask Hjorth CSIC ORCID | artículo |
| openAccess |  | 2012 | Inversed linear dichroism in F K-edge NEXAFS spectra of fluorinated planar aromatic molecules | Oteyza, Dimas G. de CSIC ORCID; El-Sayed, Afaf CSIC ORCID; Goiri, Elizabeth CSIC ORCID; Floreano, Luca; García-Lastra, J. M.; Rubio, Angel CSIC ORCID; Ortega, J. Enrique CSIC ORCID | artículo |
| openAccess |  | 2010 | Localized edge vibrations and edge reconstruction by Joule heating in graphene nanostructures | Engelund, Mads CSIC ORCID; Fürst, J. A.; Jauho, Antti-Pekka; Brandbyge, Mads | artículo |
| openAccess |  | 2010 | Modeling nanoscale gas sensors under realistic conditions: Computational screening of metal-doped carbon nanotubes | García-Lastra, J. M.; Mowbray, Duncan J. CSIC ORCID; Thygesen, Kristian S.; Rubio, Angel CSIC ORCID; Jacobsen, K. W. | artículo |
| openAccess |  | 2008 | Δ self-consistent field method to obtain potential energy surfaces of excited molecules on surfaces | Gavnholt, Jeppe; Olsen, Thomas CSIC ORCID; Engelund, Mads CSIC ORCID; Schiøtz, Jakob | artículo |
