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Derechos | Preview | Fecha Public. | Título | Autor(es) | Tipo |
openAccess | | 16-abr-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 | | 4-oct-2023 | A high-level ab initio study of the destruction of methanimine under UV radiation | Bouallagui, A.; Zanchet, Alexandre CSIC ORCID; Al Mogren, M. Mogren; Bañares, Luis CSIC ORCID; García Vela, Alberto CSIC ORCID | artículo |
closedAccess | | 17-ene-2017 | Ab initio study of the photodissociation of radical molecules of astrochemical interest | Bouallagui, Aymen CSIC; Zanchet, Alexandre CSIC ORCID; Jaidane, N.; Yazidi, O.; Senent, María Luisa CSIC ORCID ; Bañares, Luis CSIC ORCID; García Vela, Alberto CSIC ORCID | comunicación de congreso |
openAccess | | 11-sep-2016 | Ab initio study on the photodissociation of CH3O and CH3S radicals : The effect of spin-orbit coupling | Bouallagui, Aymen CSIC; Zanchet, Alexandre CSIC ORCID; Jaidane, N.; Yazidi, O.; Senent, María Luisa CSIC ORCID ; Bañares, Luis CSIC ORCID; García Vela, Alberto CSIC ORCID | póster de congreso |
openAccess | | 15-nov-2016 | An ab initio study of the ground and excited electronic states of the methyl radical | Zanchet, Alexandre CSIC ORCID; Bañares, Luis CSIC ORCID; Senent, María Luisa CSIC ORCID ; García Vela, Alberto CSIC ORCID | artículo |
openAccess | | 2-ago-2023 | An ab initio study of the photodissociation of CH2I and CH2I | Bouallagui, A.; Zanchet, Alexandre CSIC ORCID; Bañares, Luis CSIC ORCID; García Vela, Alberto CSIC ORCID | artículo |
openAccess | | 28-feb-2022 | An ab initio study of the photodissociation of the vinyl radical | Bouallagui, Aymen CSIC; Zanchet, Alexandre CSIC ORCID; Bañares, Luis CSIC ORCID; García Vela, Alberto CSIC ORCID | artículo |
openAccess | | 26-abr-2012 | An accurate study of the dynamics of the C+OH reaction on the second excited 1^4 A'' potential energy surface | Zanchet, Alexandre CSIC ORCID; González-Lezana, Tomás CSIC ORCID ; Roncero, Octavio CSIC ORCID ; Jorfi, Mohamed; Honvault, Pascal; Hankel, M. | 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 | | 2013 | Constantes ópticas de hielos de NH3 y NH3:N2 en IR medio y próximo | Maté, Belén CSIC ORCID; Zanchet, Alexandre CSIC ORCID; Rodríguez Lazcano, Yamilet CSIC; Gálvez, Óscar CSIC ORCID; Moreno, Miguel Ángel CSIC; Escribano, Rafael CSIC ORCID; Herrero, Víctor J. CSIC ORCID | comunicación de congreso |
openAccess | | 2023 | Cover Feature: Stability and Reversible Oxidation of Sub-Nanometric Cu5 Metal Clusters: Integrated Experimental Study and Theoretical Modeling | Buceta, David; Huseyinova, Shahana; Cuerva, Miguel; Lozano, Héctor; Giovanetti, Lisandro J.; Ramallo-López, José M.; López-Caballero, Patricia CSIC ORCID; Zanchet, Alexandre CSIC ORCID; Mitrushchenkov, Alexander O.; Hauser, Andreas W.; Barone, Giampaolo; Huck-Iriart, Cristián; Escudero, Carlos; Hernández-Garrido, Juan Carlos; Calvino, José Juan; López-Haro, Miguel; Lara Castells, María Pilar de CSIC ORCID ; Requejo, Félix G.; López-Quintela, M. Arturo | otro |
openAccess | | dic-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 |
closedAccess | | ago-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 | | 25-sep-2020 | DpgC-Catalyzed Peroxidation of 3,5-Dihydroxyphenylacetyl-CoA(DPA-CoA): Insights into the Spin-Forbidden Transition and Charge Transfer Mechanisms** | Ortega, P.; Zanchet, Alexandre CSIC ORCID; Sanz-Sanz, Cristina CSIC ORCID; Gómez Carrasco, Susana CSIC ORCID CVN; González-Sánchez, Lola; Jambrina, P.G. | 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 |
openAccess | | 11-abr-2016 | Effect of the highly excited robibrational levels on the endothermic reaction between of S+ and H2. | Zanchet, Alexandre CSIC ORCID | comunicación de congreso |
openAccess | | 27-jun-2016 | Effect of the highly excited rovibrational levels on the endothermic reaction between of S+ and H2 | Zanchet, Alexandre CSIC ORCID; Roncero, Octavio CSIC ORCID ; Bulut, N. | póster de congreso |
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 |
closedAccess | | 2016 | Femtosecond predissociation dynamics of the methyl radical from the 3pz Rydberg state | Balerdi, G.; Woodhouse, J.; Zanchet, Alexandre CSIC ORCID; de Nalda, R. CSIC ORCID; Senent, María Luisa CSIC ORCID ; García Vela, Alberto CSIC ORCID; Bañares, Luis CSIC ORCID | artículo |
openAccess | | 20-jul-2018 | Formation and Destruction of SiS in Space | Zanchet, Alexandre CSIC ORCID; Roncero, Octavio CSIC ORCID ; Agúndez, Marcelino CSIC ORCID; Cernicharo, José CSIC ORCID | artículo |