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| Rights | Preview | Issue Date | Title | Author(s) | Type |
| openAccess |  | 16-Apr-2015 | A comparative study of the Au + H2, Au+ + H2, and Au− + H2 systems: Potential energy surfaces and dynamics of reactive collisions | Dorta-Urra, A. CSIC; Zanchet, Alexandre CSIC ORCID; Roncero, Octavio CSIC ORCID ; Aguado, Alfredo CSIC ORCID | artículo |
| openAccess |  | 10-Apr-2018 | A Ring Polymer Molecular Dynamics Approach to Study the Transition between Statistical and Direct Mechanisms in the H2 + H3 + → H3 + + H2 Reaction | Suleimanov, Yury V.; Aguado, Alfredo CSIC ORCID; Gómez Carrasco, Susana CSIC ORCID CVN; Roncero, Octavio CSIC ORCID | artículo |
| openAccess |  | 11-Sep-2016 | Adding exchange and multiple splitting terms to correct the long range in the H3 + potential surface | Sanz-Sanz, Cristina CSIC ORCID; Aguado, Alfredo CSIC ORCID; Roncero, Octavio CSIC ORCID | póster de congreso |
| openAccess |  | 2-Mar-2021 | Bottlenecks to interstellar sulfur chemistry: Sulfur-bearing hydrides in UV-illuminated gas and grains | Goicoechea, Javier R. CSIC ORCID; Aguado, Alfredo CSIC ORCID; Cuadrado, S.; Roncero, Octavio CSIC ORCID ; Pety, J.; Bron, E.; Fuente, A.; Riquelme, D.; Chapillon, E.; Herrera, C.; Duran, C.A. | artículo |
| openAccess |  | 2011 | Communication: Theoretical exploration of AuH2, D2, and HD reactive collisions | Dorta-Urra, A. CSIC; Zanchet, Alexandre CSIC ORCID; Roncero, Octavio CSIC ORCID ; Aguado, Alfredo CSIC ORCID; Armentrout, P.B. | artículo |
| openAccess |  | 26-Oct-2006 | Coupled diabatic potential energy surfaces for studying the nonadiabatic dynamics at conical intersections in angular resolved photodetachment simulations of OHF- --> OHF+e- | Gómez Carrasco, Susana CSIC ORCID CVN; Aguado, Alfredo CSIC ORCID; Paniagua, Miguel; Roncero, Octavio CSIC ORCID | artículo |
| closedAccess |  | 6-Feb-2015 | Density-difference-driven optimized embedding potential method to study the spectroscopy of Br2 in water clusters | Roncero, Octavio CSIC ORCID ; Aguado, Alfredo CSIC ORCID; Batista-Romero, F.A.; Bernal-Uruchurtu, M.I.; Hernández-Lamoneda, Ramón | artículo |
| openAccess |  | Dec-2009 | A density-division embedding potential inversion technique | Roncero, Octavio CSIC ORCID ; Zanchet, Alexandre CSIC ORCID; Villarreal, Pablo CSIC ORCID; Aguado, Alfredo CSIC ORCID | artículo |
| openAccess |  | 29-Apr-2014 | Depolarizing collisions with hydrogen: Neutral and singly ionized alkaline earths | Manso Sáinz, Rafael; Roncero, Octavio CSIC ORCID ; Sanz-Sanz, Cristina CSIC ORCID; Aguado, Alfredo CSIC ORCID; Asensio Ramos, Andrés; Trujillo Bueno, J. | preprint |
| closedAccess | | Aug-2009 | Differential cross sections and product rotational polarization in A + BC reactions using wave packet methods: H+ D2 and Li + HF examples | Zanchet, Alexandre CSIC ORCID; Roncero, Octavio CSIC ORCID ; González-Lezana, Tomás CSIC ORCID ; Rodríguez-López, A.; Aguado, Alfredo CSIC ORCID; Sanz, Cristina; Gómez Carrasco, Susana CSIC ORCID CVN | artículo |
| openAccess |  | 8-Sep-2004 | Direct versus resonances mediated F+OH collisions on a new 3A'' potential energy surface | Gómez Carrasco, Susana CSIC ORCID CVN; González-Sánchez, Lola; Aguado, Alfredo CSIC ORCID; Roncero, Octavio CSIC ORCID ; Alvariño, José M.; Hernández, M. Luz; Paniagua, Miguel | artículo |
| openAccess | | 2012 | Dynamically biased statistical model for the ortho/para conversion in the H 2+H 3 + → H 3 + + H 2 reaction | Gómez Carrasco, Susana CSIC ORCID CVN; González-Sánchez, Lola; Aguado, Alfredo CSIC ORCID; Sanz-Sanz, Cristina CSIC ORCID; Zanchet, Alexandre CSIC ORCID; Roncero, Octavio CSIC ORCID | artículo |
| closedAccess |  | 2004 | Dynamics and kinetics of the F + OH reaction on the ground triplet potential energy surface | Gómez Carrasco, Susana CSIC ORCID CVN; González-Sánchez, Lola; Aguado, Alfredo CSIC ORCID; Paniagua, Miguel; Roncero, Octavio CSIC ORCID ; Hernández, M. Luz; Alvariño, José M. | artículo |
| openAccess |  | 8-Jul-2014 | Electron transport signature of H2 dissociation on atomic gold wires | Zanchet, Alexandre CSIC ORCID; Roncero, Octavio CSIC ORCID ; Dorta-Urra, A. CSIC; Aguado, Alfredo CSIC ORCID; Martínez, José I. CSIC ORCID ; Flores, Fernando; Lorente, Nicolás CSIC ORCID CVN | artículo |
| openAccess |  | 22-Sep-2005 | F+OH reactive collisions on new excited 3A'' and 3A' potential-energy surfaces | Gómez Carrasco, Susana CSIC ORCID CVN; Roncero, Octavio CSIC ORCID ; González-Sánchez, Lola; Hernández, M. Luz; Alvariño, José M.; Paniagua, Miguel; Aguado, Alfredo CSIC ORCID | artículo |
| openAccess |  | 8-Sep-2017 | Full dimensional potential energy surface and low temperature dynamics of the H2CO + OH → HCO + H2O reaction | Zanchet, Alexandre CSIC ORCID; Mazo, Pablo del; Aguado, Alfredo CSIC ORCID; Roncero, Octavio CSIC ORCID ; Jiménez, Elena; Canosa, André; Agúndez, Marcelino CSIC ORCID; Cernicharo, José CSIC ORCID | artículo |
| openAccess |  | 2013 | Full dimensional potential energy surface for the ground state of H 4 + system based on triatomic-in-molecules formalism | Sanz-Sanz, Cristina CSIC ORCID; Roncero, Octavio CSIC ORCID ; Paniagua, Miguel; Aguado, Alfredo CSIC ORCID | artículo |
| openAccess |  | 2000 | Global potential energy surfaces for the H+ 3 system. Analytical representation of the adiabatic ground-state 11A′ potential | Aguado, Alfredo CSIC ORCID; Roncero, Octavio CSIC ORCID ; Tablero, César; Sanz, Cristina; Paniagua, Miguel | artículo |
| openAccess |  | 2011 | Infrared spectrum of H5 + and D5 +: The simplest shared-proton model | Sanz-Sanz, Cristina CSIC ORCID; Roncero, Octavio CSIC ORCID ; Valdés, Álvaro CSIC ORCID; Prosmiti, Rita CSIC ORCID; Delgado Barrio, Gerardo CSIC ORCID ; Villarreal, Pablo CSIC ORCID; Barragán, Patricia CSIC ORCID; Aguado, Alfredo CSIC ORCID | artículo |
| openAccess |  | 10-Nov-2008 | An inversion technique for the calculation of embedding potentials | Roncero, Octavio CSIC ORCID ; Lara Castells, María Pilar de CSIC ORCID ; Villarreal, Pablo CSIC ORCID; Flores, F.; Ortega, J.; Paniagua, Miguel; Aguado, Alfredo CSIC ORCID | artículo |
