English   español  

Browsing by Author rp08545

Jump to: 0-9 A B C D E F G H I J K L M N O P Q R S T U V W X Y Z
or enter first few letters:  
Showing results 1 to 20 of 32  next >
RightsPreviewIssue DateTitleAuthor(s)Type
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, Gerardo  Artículo
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, Gerardo  Artículo
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
closedAccess18-Jun-2007Doped helium clusters analyzed through quantum chemistry methodsLara Castells, María Pilar de ; Prosmiti, Rita ; López Durán, David; Delgado Barrio, Gerardo  ; Villarreal, Pablo ; Gianturco, Franco Antonio; Jellinek, J.Artículo
closedAccess28-Apr-2007Dynamics and potential energy surfaces for small to medium size He(n)-dihalogen clustersDelgado Barrio, Gerardo  ; Valdés, Álvaro ; López Durán, David; Lara Castells, María Pilar de ; Prosmiti, Rita ; Villarreal, Pablo Comunicación de congreso
openAccessIJQC06_revised.pdf.jpg9-May-2007Exact and quantum chemistry-like calculations in helium doped clusters: The He2Br2(X) exampleRoncero, Octavio ; Pérez de Tudela, Ricardo ; Lara Castells, María Pilar de ; Prosmiti, Rita ; Delgado Barrio, Gerardo  ; Villarreal, Pablo Artículo
openAccessBorn_Oppenheimer_JChemPhys_2008.pdf.jpg29-Apr-2008Exact, Born–Oppenheimer, and quantum-chemistry-like calculations in helium clusters doped with light molecules: The He2N2(X) systemRoncero, Octavio ; Lara Castells, María Pilar de ; Delgado Barrio, Gerardo  ; Villarreal, Pablo ; Stoecklin, T.; Voronin, A.; Rayez, J. C.Artículo
openAccessnuclear_orbital_JChemPhys_2006.pdf.jpg8-Dec-2006A full-configuration interaction "nuclear orbital'' method to study doped 3He(N) clusters (N<=4)Lara Castells, María Pilar de ; Delgado Barrio, Gerardo  ; Villarreal, Pablo ; Mitrushchenkov, Alexander O. Artículo
openAccessGetPDFServlet.pdf.jpg1-Oct-2002He79Br2 B,v = 8_X,v ''= 0 excitation spectrum: Ab initio prediction and spectroscopic manifestation of a linear isomerBuchachenko, Alexei A.; Prosmiti, Rita ; Cunha, Carlos; Delgado Barrio, Gerardo  ; Villarreal, Pablo Artículo
closedAccessMay-2007Key role of spin-orbit effects in the relaxation of CO2(010) by thermal collisions with O(3Pj)Lara Castells, María Pilar de ; Hernández, Marta I. ; Delgado Barrio, Gerardo  ; Villarreal, Pablo ; López-Puertas, Manuel Artículo
openAccessbr2he3-rev.pdf.jpg8-Feb-2010Microscopic description of small doped 3He clusters through the Full-Configuration-Interaction Nuclear Orbital approach: the (3He)N-Br2(X) case revisitedLara Castells, María Pilar de ; Villarreal, Pablo ; Delgado Barrio, Gerardo  Artículo
openAccessJCP-Aguado-etal-2010.pdf.jpg14-Jul-2010A new accurate and full dimensional potential energy surface of H5+ based on a triatomics-in-molecules analytic functional formAguado, Alfredo ; Barragán, Patricia ; Prosmiti, Rita ; Delgado Barrio, Gerardo  ; Villarreal, Pablo ; Roncero, Octavio Artículo
openAccessGetPDFServlet.pdf.jpg16-Nov-2009An optimized full-configuration-interaction nuclear orbital approach to a “hard-core” interaction problem: Application to (3He)N–Cl2(B) clusters (N<4)Lara Castells, María Pilar de ; Villarreal, Pablo ; Delgado Barrio, Gerardo  ; Mitrushchenkov, Alexander O. Artículo
openAccessphysscr_73_1_n11.pdf.jpgJan-2006An overview on potential energy surfaces of rare-gas dihalogen van der Waals clustersDelgado Barrio, Gerardo  ; Prosmiti, Rita ; Valdés, Álvaro ; Villarreal, Pablo Artículo
openAccessRonceroI.pdf.jpg23-Jun-2010A path-integral Monte Carlo study of a small cluster: The Ar trimerPérez de Tudela, Ricardo ; Márquez-Mijares, Maykel ; González-Lezana, Tomás  ; Roncero, Octavio ; Miret-Artés, Salvador ; Delgado Barrio, Gerardo  ; Villarreal, Pablo Artículo
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 ; Delgado Barrio, Gerardo  ; López Durán, David; Villarreal, Pablo ; Gianturco, Franco Antonio; Jellinek, J.Artículo
openAccessArbor_file.pdf.jpg30-Dec-2007Presentación [del número monográfico de Arbor dedicado a «Einstein, la JAE y el nacimiento de la Física moderna en España»]Delgado Barrio, Gerardo  Artículo
openAccess41528_1_art_file_251258_l0vxjn.pdf.jpg28-Apr-2010Quantum solvent states and ro-vibrational spectra of small dopedLara Castells, María Pilar de ; Aguirre, Néstor F. ; Villarreal, Pablo ; Delgado Barrio, Gerardo  Pre-print
openAccessJCPSA613219194313_1.pdf.jpg21-May-2010Quantum solvent states and rovibrational spectra of small doped 3He clusters through the full-configuration-interaction nuclear orbital approach: The „ (3He)N–Cl2„(X) case (N<4)Lara Castells, María Pilar de ; Aguirre, Néstor F. ; Villarreal, Pablo ; Delgado Barrio, Gerardo  ; Mitrushchenkov, Alexander O. Artículo