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Browsing by Author Paniagua, Miguel

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openAccessCoupled_diabatic_JChemPhys_2006.pdf.jpg26-Oct-2006Coupled diabatic potential energy surfaces for studying the nonadiabatic dynamics at conical intersections in angular resolved photodetachment simulations of OHF- --> OHF+e-Gómez Carrasco, Susana; Aguado, Alfredo; Paniagua, Miguel; Roncero, OctavioArtículo
openAccessDirect_versus_resonances_JChemPhys_2004.pdf.jpg8-Sep-2004Direct versus resonances mediated F+OH collisions on a new 3A'' potential energy surfaceGómez Carrasco, Susana; González-Sánchez, Lola; Aguado, Alfredo; Roncero, Octavio; Alvariño, José M.; Hernández, M. Luz; Paniagua, MiguelArtículo
closedAccessaccesoRestringido.pdf.jpg2004Dynamics and kinetics of the F + OH reaction on the ground triplet potential energy surfaceGómez Carrasco, Susana; González-Sánchez, Lola; Aguado, Alfredo; Paniagua, Miguel; Roncero, Octavio; Hernández, M. Luz; Alvariño, José M.Artículo
openAccessFOH_JChemPhys_2005.pdf.jpg22-Sep-2005F+OH reactive collisions on new excited 3A'' and 3A' potential-energy surfacesGómez Carrasco, Susana; Roncero, Octavio; González-Sánchez, Lola; Hernández, M. Luz; Alvariño, José M.; Paniagua, Miguel; Aguado, AlfredoArtículo
openAccessSanz-Sanz.pdf.jpg2013Full dimensional potential energy surface for the ground state of H 4 + system based on triatomic-in-molecules formalismSanz-Sanz, Cristina; Roncero, Octavio; Paniagua, Miguel; Aguado, AlfredoArtículo
openAccessAguado.pdf.jpg2000Global potential energy surfaces for the H+ 3 system. Analytical representation of the adiabatic ground-state 11A′ potentialAguado, Alfredo; Roncero, Octavio; Tablero, César; Sanz, Cristina; Paniagua, MiguelArtículo
openAccessInversion_technique_JChemPhys_2008.pdf.jpg10-Nov-2008An inversion technique for the calculation of embedding potentialsRoncero, Octavio; Lara Castells, M. Pilar de; Villarreal, Pablo; Flores, F.; Ortega, J.; Paniagua, Miguel; Aguado, AlfredoArtículo
closedAccess2009Mechanism of molecular hydrogen dissociation on gold chains and clusters as model prototypes of nanostructuresZanchet, Alexandre; Dorta-Urra, A.; Roncero, Octavio; Flores, F.; Tablero, César; Paniagua, Miguel; Aguado, AlfredoArtículo
openAccessPhotodetachment_JChemPhys_2004.pdf.jpg1-Jul-2004Photodetachment spectrum of OHF-: Three-dimensional study of the heavy–light–heavy resonancesGonzález-Sánchez, Lola; Gómez Carrasco, Susana; Aguado, Alfredo; Paniagua, Miguel; Hernández, M. Luz; Alvariño, José M.; Roncero, OctavioArtículo
openAccessJCP132-034301.pdf.jpg15-Jan-2010Potential energy surface and reactive collisions for the Au+H2 systemZanchet, Alexandre; Roncero, Octavio; Omar, Salama; Paniagua, Miguel; Aguado, AlfredoArtículo
openAccessAguado.pdf.jpg1997Potential energy surface and wave packet calculations on the Li+HF→LiF+H reactionAguado, Alfredo; Paniagua, Miguel; Lara, Manuel; Roncero, OctavioArtículo
openAccessJChemPhys_2005.pdf.jpg16-Nov-2005Quantum approaches for the insertion dynamics of the H(+) + D2 and D(+) + H2 reactive collisionsGonzález Lezana, Tomás; Aguado, Alfredo; Paniagua, Miguel; Roncero, OctavioArtículo
closedAccessNov-2004Quantum stereodynamics of the F+OH(v, j) reactive collision on the 1(3) A'' stateGonzález-Sánchez, Lola; Gómez Carrasco, Susana; Aguado, Alfredo; Paniagua, Miguel; Hernández, M. Luz; Alvariño, José M.; Roncero, OctavioArtículo
openAccessLara.pdf.jpg1998Quantum stereodynamics of the Li+HF(v,j) reactive collision for different initial states of the reagentLara, Manuel; Aguado, Alfredo; Roncero, Octavio; Paniagua, MiguelArtículo
openAccessAguado.pdf.jpg1997Quantum study of the Li+HF→LiF+H reactionAguado, Alfredo; Paniagua, Miguel; Lara, Manuel; Roncero, OctavioArtículo
openAccessLara.pdf.jpg2000State-to-state reaction probabilities using bond coordinates: application to the Li+HF(v,j) collisionLara, Manuel; Aguado, Alfredo; Paniagua, Miguel; Roncero, OctavioArtículo
openAccessSanz.pdf.jpg2001The lowest triplet state 3A′ of H3 +: Global potential energy surface and vibrational calculationsSanz, Cristina; Roncero, Octavio; Tablero, César; Aguado, Alfredo; Paniagua, MiguelArtículo
openAccessTransition_state_dynamics_JChemPhys_2004.pdf.jpg22-Nov-2004Transition state dynamics of OHF on several electronic states: Photodetachment spectrum of OHF- and conical intersectionsGonzález-Sánchez, Lola; Gómez Carrasco, Susana; Aguado, Alfredo; Paniagua, Miguel; Hernández, M. Luz; Alvariño, José M.; Roncero, OctavioArtículo
openAccessTransition_state_spectroscopy_revised.pdf.jpg2-Feb-2007Transition state spectroscopy of open shell systems: Angle-resolved photodetachment spectra for the adiabatic singlet states of OHFGómez Carrasco, Susana; Aguado, Alfredo; Paniagua, Miguel; Roncero, OctavioArtículo
openAccessTransition_state_spectroscopy_JChemPhys_2003.pdf.jpg15-Nov-2003Transition state spectroscopy of the excited electronic states of Li–HFAguado, Alfredo; Paniagua, Miguel; Sanz, Cristina; Roncero, OctavioArtículo