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Browsing by Author Castro, Alberto

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RightsPreviewIssue DateTitleAuthor(s)Type
closedAccessaccesoRestringido.pdf.jpg2010Ab initio modelling of the excited state dynamics of clusters and nanostructures with time-dependent density-functional theory: linear and nonlinear regimesAlonso, J. A. CSIC ORCID; Castro, Alberto; Rubio, Angelcapítulo de libro
openAccessAb initio molecular.pdf.jpg2010Ab initio molecular dynamics on the electronic Boltzmann equilibrium distributionAlonso, José Luis; Castro, Alberto; Echenique, Pablo CSIC ORCID; Polo, Víctor; Rubio, Angel; Zueco, David CSIC ORCIDartículo
closedAccessaccesoRestringido.pdf.jpgNov-2004Calculation of the optical spectrum of the Ti8C12 and V8C12 Met-CarsMartínez, José I. CSIC ORCID ; Castro, Alberto; Rubio, Angel; Poblet, J. M.; Alonso, J. A. CSIC ORCIDartículo
openAccessCan optical spectroscopy.pdf.jpg2002Can optical spectroscopy directly elucidate the ground state of C 20?Castro, Alberto; Marques, Miguel A. L.; Alonso, J. A. CSIC ORCID; Bertsch, George F.; Yabana, K.; Rubio, Angelartículo
openAccessCluster_Surface.pdf.jpg29-Jul-2008Cluster-surface and cluster-cluster interactions: ab initio calculations and modelling of Van der Waals forcesBotti, Silvana; Castro, Alberto; Andrade, Xavier; Rubio, Angel; Marques, Miguel A. L.artículo
openAccessCoherent manipulation.pdf.jpg4-Mar-2019Coherent manipulation of three spin qubits in a GdW30 single-ion magnet* [Luis, Fernando CSIC ORCID; Jenkins, Mark CSIC; Duan, Yan; García-Ripoll, Juan José CSIC ORCID ; Gaita-Ariño, Alejandro; Giménez-Saiz, Carlos; Alonso, Pablo J. CSIC ORCID; Castro, Alberto; Zueco, David CSIC ORCID; Coronado, Eugeniocomunicación de congreso
openAccessCoherent quantumswitch.pdf.jpg11-Oct-2007Coherent quantum switch driven by optimized laser pulsesRäsänen, E.; Castro, Alberto; Werschnik, J.; Rubio, Angel; Gross, E. K. U.artículo
openAccesscontrolgenerati.pdf.jpg2008Control of high-field phenomena on molecules and clusters: ionization and high harmonic generationCastro, Alberto; Räsänen, E.; Akbari, A. CSIC; Rubio, Angel; Gross, E. K. U.póster de congreso
openAccessenhancingcontrolling.pdf.jpg2015Enhancing and controlling single-atom high-harmonic generation spectra: a time-dependent density-functional schemeCastro, Alberto; Rubio, Angel; Gross, E. K. U.artículo
openAccess2004Excited states dynamics in time-dependent density functional theory: High-field molecular dissociation and harmonic generationCastro, Alberto; Marques, Miguel A. L.; Alonso, J. A. CSIC ORCID; Bertsch, George F.; Rubio, Angelartículo
openAccessFemtosecond.pdf.jpg2009Femtosecond laser pulse shaping for enhanced ionizationCastro, Alberto; Räsänen, E.; Rubio, Angel; Gross, E. K. U.artículo
openAccessModified Ehrenfest.pdf.jpg2009Modified Ehrenfest formalism for efficient large-scale ab initio molecular dynamicsAndrade, Xavier; Castro, Alberto; Zueco, David CSIC ORCID; Alonso, J. A. CSIC ORCID; Echenique, Pablo CSIC ORCID; Falceto, Fernando; Rubio, Angelartículo
openAccessNon-adiabatic effects within.pdf.jpg31-Aug-2012Non-adiabatic effects within a single thermally averaged potential energy surface: Thermal expansion and reaction rates of small moleculesAlonso, José Luis; Castro, Alberto; Clemente-Gallardo, Jesús; Echenique, Pablo CSIC ORCID; Mazo, J. J. CSIC ORCID; Polo, Víctor; Rubio, Angel; Zueco, David CSIC ORCIDartículo
openAccessPhysRevE.91.022137-1.pdf.jpg2015Nonextensive thermodynamic functions in the Schrödinger-Gibbs ensembleAlonso, José Luis; Castro, Alberto; Clemente-Gallardo, Jesús; Cuchí, Juan Carlos; Echenique, Pablo CSIC ORCID; Esteve, J.G.; Falceto, F.artículo
openAccessoctopusystem.pdf.jpg2020Octopus, a computational framework for exploring light-driven phenomena and quantum dynamics in extended and finite systemsTancogne-Dejean, Nicolas; Oliveira, Micael J. T.; Andrade, Xavier; Appel, H.; Borca, Carlos H.; Le Breton, Guillaume; Buchholz, Florian; Castro, Alberto; Corni, Stefano; Correa, Alfredo A.; Giovannini, Umberto de; Delgado, Alain; Eich, F. G.; Flick, Johannes; Gil, Gabriel; Gomez, Adrián; Helbig, N. CSIC ORCID; Hübener, Hannes; Jestädt, René; Jornet-Somoza, Joaquim; Larsen, Ask Hjorth; Lebedeva, Irina CSIC ORCID; Lüders, Martin; Marques, Miguel A. L.; Ohlmann, Sebastian T.; Pipolo, Silvio; Rampp, Markus; Rozzi, Carlo Andrea; Strubbe, David A.; Sato, Shunsuke A.; Schäfer, Christian; Theophilou, Iris; Welden, Alicia; Rubio, Angelartículo
openAccessoctopus a first principles.pdf.jpgMar-2003octopus: a first-principles tool for excited electron–ion dynamicsMarques, Miguel A. L.; Castro, Alberto; Bertsch, George F.; Rubio, Angelartículo
openAccessoctopus a tool for.pdf.jpgSep-2006octopus: a tool for the application of time-dependent density functional theoryCastro, Alberto; Appel, H.; Oliveira, Micael J. T.; Rozzi, Carlo Andrea; Andrade, Xavier; Lorenzen, Florian; Marques, Miguel A. L.; Gross, E. K. U.; Rubio, Angelartículo
openAccess2012_TDDFTandMD.pdf.jpg2012On the combination of TDDFT with molecular dynamics: New developmentsAlonso, José Luis; Castro, Alberto; Echenique, Pablo CSIC ORCID; Rubio, Angelcapítulo de libro
closedAccessaccesoRestringido.pdf.jpgJul-2008On the use of Neumann's principle for the calculation of the polarizability tensor of nanostructuresOliveira, Micael J. T.; Castro, Alberto; Marques, Miguel A. L.; Rubio, Angelartículo
closedAccessaccesoRestringido.pdf.jpg2005Optical absorption of the blue fluorescent protein: A first-principles studyLópez, Xabier; Marques, Miguel A. L.; Castro, Alberto; Rubio, Angelartículo