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Browsing by Author Prosmiti, Rita

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RightsPreviewIssue DateTitleAuthor(s)Type
closedAccessaccesoRestringido.pdf.jpg2002A combined classical/quantum study of the photodissociation dynamics of NeBr2(B) near the Br2(B) dissociation limitProsmiti, Rita; Villarreal, Pablo; Delgado Barrio, Gerardo; Roncero, OctavioArtículo
closedAccessaccesoRestringido.pdf.jpg2013A DFT based potential energy surface for the H7+ clusterBarragán, Patricia; Prosmiti, RitaArtículo
closedAccessaccesoRestringido.pdf.jpg4-Jul-2010A global potential surface for H+3 from DFT calculationsBarragán, P.; Prosmiti, Rita; Villarreal, Pablo; Delgado Barrio, GerardoPóster
openAccess2012A quantum chemistry approach to energies, structures, and spectroscopy of doped helium clustersPérez de Tudela, Ricardo; López Durán, David; Lara Castells, María Pilar de; Prosmiti, Rita; Roncero, Octavio; Delgado Barrio, Gerardo; Gainturco, F.A.; Jellinek, J.; Villarreal, PabloArtículo
openAccessProsmiti.pdf.jpg24-Feb-2010A realistic DFT potential energy surface for H+5 clusterProsmiti, RitaComunicación de congreso
openAccessProsmiti2.pdf.jpg9-Feb-2012A theoretical study of H+5: potential surfaces and vibrational dynamicsProsmiti, RitaComunicación de congreso
openAccessGetPDFServlet.pdf.jpg5-Jan-2005Ab initio calculations, potential representation and vibrational dynamics of He2Br2 van der Waals complexValdés, Álvaro; Prosmiti, Rita; Villarreal, Pablo; Delgado Barrio, GerardoArtículo
openAccessDelgado.pdf.jpg2011Ab initio characterization of the Ne-I2 van der Waals complex: Intermolecular potentials and vibrational bound statesDelgado Tellez, Laura; Valdés, Álvaro; Prosmiti, Rita; Villarreal, Pablo; Delgado Barrio, GerardoArtículo
closedAccessaccesoRestringido.pdf.jpg5-Jul-2011Ab initio Cheracterization of NeI2 vdW complexDelgado Téllez, Laura; Prosmiti, Rita; Valdes, Alvaro; Villarreal, Pablo; Delgado Barrio, GerardoPóster
openAccessGetPDFServlet.pdf.jpg1-Jun-2002Ab initio ground state potential energy surfaces for Rg–Br2 (Rg = He, Ne, Ar) complexesProsmiti, Rita; Cunha, Carlos; Villarreal, Pablo; Delgado Barrio, GerardoArtículo
closedAccessaccesoRestringido.pdf.jpg4-Jul-2010Ab initio PIMC/CMC calculations: Quantum and thermal effects in H+5 clusterProsmiti, Rita; Barragán, P.; Pérez de Tudela, Ricardo; Villarreal, Pablo; Delgado Barrio, GerardoPóster
openAccessAbInitio.pdf.jpg10-Sep-2014Ab initio potential energy curves of the valence, Rydberg and ion-pair states of iodine monochloride, IClKalemos, Apostolos; Prosmiti, RitaArtículo
openAccessHeI2_complex_JChemPhys_2007.pdf.jpg22-May-2007Ab initio potential energy surface and spectrum of the B(3Π) state of the HeI2 complexValdés, Álvaro; Prosmiti, Rita; Villarreal, Pablo; Delgado Barrio, Gerardo; Werner, Hans-JoachimArtículo
openAccessAb_initio_JChemPhys_2007.pdf.jpg29-Jun-2007Ab initio vibrational predissociation dynamics of He-I2(B) complexValdés, Álvaro; Prosmiti, Rita; Villarreal, Pablo; Delgado Barrio, Gerardo; Lemoine, Didier; Lepetit, BrunoArtículo
closedAccessaccesoRestringido.pdf.jpg2007Additive intermolecular potentials from ab initio calculations: Trends in Rg2-dihalogen van der Waals trimersDiez-Pardos, Carmen; Valdés, Álvaro; Prosmiti, Rita; Villarreal, Pablo; Delgado Barrio, GerardoArtículo
closedAccessaccesoRestringido.pdf.jpg2012An ab initio study of the e 3Π g state of the iodine moleculeKalemos, Apostolos; Valdes, Alvaro; Prosmiti, RitaArtículo
openAccessAnionic.pdf.jpg26-Apr-2015Anionic He*- and He2*- Species in He Clusters: Large Anharmonic and Anisotropic EffectsRodríguez-Cantano, Rocío; González-Lezana, Tomás; Prosmiti, Rita; Villarreal, Pablo; Delgado Barrio, Gerardo; Huber, S.E.; Mauracher, A.; Gianturco, Franco A.Comunicación de congreso
closedAccessaccesoRestringido.pdf.jpg17-Jul-2011Calculations of the viscosities of liquid water by molecular sumulations with polarizable intearction potentialsFanourgakis, George S; Medina, J.; Prosmiti, Rita; Villarreal, Pablo; Delgado Barrio, GerardoPóster
closedAccessaccesoRestringido.pdf.jpg5-Jul-2011Calculations of the viscosities of pure liquid water by molecular dynamics sumulationsFanourgakis, George S; Medina, J. S.; Prosmiti, Rita; Villarreal, Pablo; Delgado Barrio, GerardoPóster
closedAccessaccesoRestringido.pdf.jpg23-Feb-2015Computational investigations of the thermodynamic properties of size-selected water and Ar-water clusters: high-pressure transitionsVítek, Aleš; Arismendi- Arrieta, D. J.; Rodríguez-Cantano, Rocío; Prosmiti, Rita; Villarreal, Pablo; Delgado Barrio, GerardoArtículo