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Browsing by Author López Durán, David

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closedAccessembargo.pdf.jpg2009(4He)N-Cs2(2¿), N=2 up to 12, clusters: a Hartree-like approachLópez Durán, David; Lara Castells, María Pilar de ; Delgado Barrio, Gerardo CSIC ORCID ; Villarreal, Pablo CSIC ORCID; Coccia, E.; Gianturco, Franco Antonio; Yurtsever, Ersincomunicación de congreso
openAccessembargo.pdf.jpg2003A quantum chemistry approach for the study of small doped 3He clustersLópez Durán, David; Lara Castells, María Pilar de ; Paola, C. Di.; Villarreal, Pablo CSIC ORCID; Delgado Barrio, Gerardo CSIC ORCID comunicación de congreso
openAccess2012A quantum chemistry approach to energies, structures, and spectroscopy of doped helium clustersPérez de Tudela, Ricardo CSIC ORCID; López Durán, David; Lara Castells, María Pilar de ; Prosmiti, Rita CSIC ORCID; Roncero, Octavio CSIC ORCID ; Delgado Barrio, Gerardo CSIC ORCID ; Gainturco, F.A.; Jellinek, J.; Villarreal, Pablo CSIC ORCIDartículo
openAccessLopezDuran0001.pdf.jpg19-Jun-2011Alkali dimers: a case of not solvated impurities in helium clustersLópez Durán, David; Pérez de Tudela, Ricardo CSIC ORCID; Rodríguez-Cantano, Rocío CSIC; González-Lezana, Tomás CSIC ORCID ; Lara Castells, María Pilar de ; Delgado Barrio, Gerardo CSIC ORCID ; Villarreal, Pablo CSIC ORCIDcomunicación de congreso
openAccessL.D.pdf.jpg3-Sep-2012Alkali dimers: a case of not solvated impurities in helium clusters.López Durán, David; Rodríguez-Cantano, Rocío CSIC; Pérez de Tudela, Ricardo CSIC ORCID; Lara Castells, María Pilar de ; González-Lezana, Tomás CSIC ORCID ; Delgado Barrio, Gerardo CSIC ORCID ; Villarreal, Pablo CSIC ORCID; Gianturco, Franco Antonio; Yurtsever, Ersincomunicación de congreso
openAccessLopezD.pdf.jpg1-Aug-2012Binding energies and structures of Ca-He 2 weakly bound triatomic complexesLópez Durán, David; Rodríguez-Cantano, Rocío CSIC; González-Lezana, Tomás CSIC ORCID ; Delgado Barrio, Gerardo CSIC ORCID ; Villarreal, Pablo CSIC ORCID; Gianturco, Franco Antonioartículo
openAccessaccesoRestringido.pdf.jpg26-Jul-2012Binding weakly interacting partners: a study of Ca-He 2 and its isotopomersLópez Durán, David; Rodríguez-Cantano, Rocío CSIC; González-Lezana, Tomás CSIC ORCID ; Delgado Barrio, Gerardo CSIC ORCID ; Villarreal, Pablo CSIC ORCID; Gianturco, Franco Antonioartículo
closedAccessaccesoRestringido.pdf.jpg2011Diffusion Monte Carlo description of Cs2(3Σ u)-(4He)N clusters: An example of weak dopant-helium interactionLópez Durán, David; Pérez de Tudela, Ricardo CSIC ORCID; Rodríguez-Cantano, Rocío CSIC; González-Lezana, Tomás CSIC ORCID ; Lara Castells, María Pilar de ; Delgado Barrio, Gerardo CSIC ORCID ; Villarreal, Pablo CSIC ORCIDartículo
closedAccess18-Jun-2007Doped helium clusters analyzed through quantum chemistry methodsLara Castells, María Pilar de ; Prosmiti, Rita CSIC ORCID; López Durán, David; Delgado Barrio, Gerardo CSIC ORCID ; Villarreal, Pablo CSIC ORCID; Gianturco, Franco Antonio; Jellinek, J.artículo
closedAccess28-Apr-2007Dynamics and potential energy surfaces for small to medium size He(n)-dihalogen clustersDelgado Barrio, Gerardo CSIC ORCID ; Valdés, Álvaro CSIC ORCID; López Durán, David; Lara Castells, María Pilar de ; Prosmiti, Rita CSIC ORCID; Villarreal, Pablo CSIC ORCIDcomunicación de congreso
closedAccessaccesoRestringido.pdf.jpg2012Helium aggregates doped with alkali dimer impurities: A finite temperature study of 4HeN-Rb2(^3 Sigma_u^+) complexesRodríguez-Cantano, Rocío CSIC; López Durán, David; Pérez de Tudela, Ricardo CSIC ORCID; González-Lezana, Tomás CSIC ORCID ; Delgado Barrio, Gerardo CSIC ORCID ; Villarreal, Pablo CSIC ORCID; Gianturco, F.A.artículo
openAccessSanz.pdf.jpg2012Investigating transition state resonances in the time domain by means of Bohmian mechanics: The F + HD reactionSanz, Ángel S. CSIC ORCID; López Durán, David; González-Lezana, Tomás CSIC ORCID preprint
closedAccessaccesoRestringido.pdf.jpg2009LiH-(X2∑+)+3,4He rotational quenching at ultralow energies: spin-flip and isotopic effects from quantum dynamics on an ionic systemLópez Durán, David; Tacconi, M.; Gianturco, Franco A.artículo
openAccessFAMA.pdf.jpgFeb-2010Molecular photoreactivity on metal-oxide surfaces from first-principles: photocathalysis and photovoltaicsLara Castells, María Pilar de ; Aguirre, Néstor F. CSIC ORCID; López Durán, David; Ortega Mateo, José; Mitrushchenkov, Alexander O.libro
openAccessRRCantano.pdf.jpg2-Jul-2013Path integral Monte Carlo calculations of Ca impurity in helium dropletsRodríguez-Cantano, Rocío CSIC; López Durán, David; González-Lezana, Tomás CSIC ORCID ; Gianturco, Franco A.; Delgado Barrio, Gerardo CSIC ORCID ; Villarreal, Pablo CSIC ORCIDcomunicación de congreso
closedAccessaccesoRestringido.pdf.jpg19-Jun-2011Path Integral Monte Carlo simulations in Rb_2- He_N clustersRodríguez-Cantano, Rocío CSIC; López Durán, David; Delgado Barrio, Gerardo CSIC ORCID ; Yurtsever, Ersin; Gianturco, F.A.; Villarreal, Pablo CSIC ORCIDpóster de congreso
openAccesspolar_dihalogen_PRA_2006.pdf.jpg28-Nov-2006Polar di-halogen molecules solvated in bosonic helium clusters: The paradigm of ICl(X)Lara Castells, María Pilar de ; Prosmiti, Rita CSIC ORCID; Delgado Barrio, Gerardo CSIC ORCID ; López Durán, David; Villarreal, Pablo CSIC ORCID; Gianturco, Franco Antonio; Jellinek, J.artículo
closedAccessaccesoRestringido.pdf.jpg10-Sep-2014Potential energy surface and bound states of the (X4Σ)KRb-K complexLópez Durán, David; Aguirre, Néstor F. CSIC ORCID; Delgado Barrio, Gerardo CSIC ORCID ; Villarreal, Pablo CSIC ORCID; Gianturco, Franco A.; Lara Castells, María Pilar de artículo
closedAccessaccesoRestringido.pdf.jpg2011Quantum features of a barely bound molecular dopant: Cs2( 3Σu) in bosonic helium droplets of variable sizePérez de Tudela, Ricardo CSIC ORCID; López Durán, David; González-Lezana, Tomás CSIC ORCID ; Delgado Barrio, Gerardo CSIC ORCID ; Villarreal, Pablo CSIC ORCID; Gianturco, Franco Antonio; Yurtsever, Ersinartículo
closedAccessaccesoRestringido.pdf.jpgJun-2011Quantum solvent states of (3sigma)Cs2-(4He)N, 2<=N<=12, clusters.López Durán, David; Pérez de Tudela, Ricardo CSIC ORCID; Prosmiti, Rita CSIC ORCID; Delgado Barrio, Gerardo CSIC ORCID ; Villarreal, Pablo CSIC ORCID; Lara Castells, María Pilar de póster de congreso