Mostrando resultados 30 a 42 de 42
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| Derechos | Preview | Fecha Public. | Título | Autor(es) | Tipo |
| openAccess |  | 2006 | Photoabsorption spectra of Ti8 C12 metallocarbohedrynes: Theoretical spectroscopy within time-dependent density functional theory | Martínez, José I. CSIC ORCID ; Castro, Alberto; Rubio, Angel CSIC ORCID; Alonso, J. A. CSIC ORCID | artículo |
| openAccess |  | 2013 | Presentación de proyecto con acceso a PRACE: Artificial photosynthesis | Alberdi, Juan M. CSIC; Andrade, Xavier; Marques, Miguel A. L.; Nogueira, Fernando; Castro, Alberto; Rubio, Angel CSIC ORCID | presentación |
| openAccess |  | 2004 | Propagators for the time-dependent Kohn-Sham equations | Castro, Alberto; Marques, Miguel A. L.; Rubio, Angel CSIC ORCID | artículo |
| openAccess |  | 2015 | Real-space grids and the Octopus code as tools for the development of new simulation approaches for electronic systems | Andrade, Xavier; Strubbe, David A.; Giovannini, Umberto de CSIC ORCID; Larsen, Ask Hjorth CSIC ORCID; Oliveira, Micael J. T.; Alberdi-Rodríguez, Joseba CSIC ORCID; Varas, Alejandro CSIC; Theophilou, Iris; Helbig, N. CSIC ORCID; Verstraete, Matthieu J. CSIC ORCID; Stella, Lorenzo CSIC ORCID; Nogueira, Fernando; Aspuru-Guzik, Alán; Castro, Alberto; Marques, Miguel A. L.; Rubio, Angel CSIC ORCID | artículo |
| openAccess | | 2013 | Simulating pump-probe photoelectron and absorption spectroscopy on the attosecond timescale with time-dependent density functional theory | Giovannini, Umberto de CSIC ORCID; Brunetto, Gustavo; Castro, Alberto; Walkenhorst, Jessica CSIC; Rubio, Angel CSIC ORCID | artículo |
| openAccess |  | 2003 | Solution of Poisson's equation for finite systems using plane-wave methods | Castro, Alberto; Rubio, Angel CSIC ORCID; Stott, M. J. | artículo |
| openAccess |  | 7-sep-2011 | Statistics and Nosé formalism for Ehrenfest dynamics | Alonso, José Luis CSIC ORCID; Castro, Alberto; Clemente-Gallardo, Jesús; Cuchí, Juan Carlos; Echenique, Pablo CSIC ORCID; Falceto, Fernando | preprint |
| openAccess |  | 2016 | Tailored pump-probe transient spectroscopy with time-dependent density-functional theory: controlling absorption spectra | Walkenhorst, Jessica CSIC; Giovannini, Umberto de CSIC ORCID; Castro, Alberto; Rubio, Angel CSIC ORCID | artículo |
| closedAccess |  | 2009 | The challenge of predicting optical properties of biomolecules: What can we learn from time-dependent density-functional theory? | Castro, Alberto; Marques, Miguel A. L.; Varsano, Daniele; Sottile, Francesco; Rubio, Angel CSIC ORCID | artículo |
| openAccess |  | 2008 | The role of dimensionality on the quenching of spin-orbit effects in the optics of gold nanostructures | Castro, Alberto; Marques, Miguel A. L.; Romero, A. H.; Oliveira, Micael J. T.; Rubio, Angel CSIC ORCID | artículo |
| openAccess |  | 2013 | Theoretical shaping of femtosecond laser pulses for ultrafast molecular photo-dissociation with control techniques based on time-dependent density functional theory | Castro, Alberto | artículo |
| openAccess |  | 2003 | Time-dependent density-functional approach for biological chromophores: The case of the green fluorescent protein | Marques, Miguel A. L.; López, Xabier; Varsano, Daniele; Castro, Alberto; Rubio, Angel CSIC ORCID | artículo |
| openAccess |  | 2012 | Time-dependent density-functional theory in massively parallel computer architectures: the octopus project | Andrade, Xavier; Alberdi, Juan M. CSIC; Strubbe, David A.; Oliveira, Micael J. T.; Nogueira, Fernando; Castro, Alberto; Muguerza, Javier; Arruabarrena, Agustín; Louie, Steven G.; Aspuru-Guzik, Alán; Rubio, Angel CSIC ORCID; Marques, Miguel A. L. | artículo |
