1. DIGITAL.CSIC

Roncero, Octavio

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Firma en Digital.CSIC (*)
Roncero, Octavio
 
Otras firmas
Roncero, Octavio
 
Centro o Instituto
CSIC - Centro de Física Miguel A. Catalán - Instituto de Física Fundamental (CFMAC-IFF)
 
Especialización
My scientific interest focuss on quantum molecular dynamics, for the description of collisional as well as photoinitiated processes, involving reactivity and non adiabatic transitions. To this aim I have developed methods and codes for studying quantum dynamics (such as wave packets, time independent close coupling methods, bound states, etc), and for the obtaining of potential energy surfaces (adiabatic surface fitting, diabatization techniques to get coupled diabatic electronic states, embedding techniques,etc).
 
Email
oroncero@imaff.cfmac.csic.es
 
ORCID
 
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Otros - ResearchGate
 
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Publications

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Autor:  Roncero, Octavio
Autor:  Sanz-Sanz, Cristina

Resultados 1-13 de 13.

DerechosPreviewFecha Public.TítuloAutor(es)Tipo
1openAccessSanzSanz.pdf.jpg22-mar-2012Communication: Quantum Zeno-based control mechanism for molecular fragmentationSanz-Sanz, Cristina CSIC ORCID; Sanz, Ángel S. CSIC ORCID; González-Lezana, Tomás CSIC ORCID ; Roncero, Octavio CSIC ORCID ; Miret-Artés, Salvador CSIC ORCIDartículo
2openAccessRoncero.pdf.jpg10-jun-2010Communications: a model study on the electronic predissociation of the NeBr2 van der Waals complexSanz-Sanz, Cristina CSIC ORCID; Roncero, Octavio CSIC ORCID ; Hernández-Lamoneda, Ramón; Pio, Jordán M.; Taylor, Molly A.; Janda, Kenneth C.artículo
3openAccess2012Dynamically biased statistical model for the ortho/para conversion in the H 2+H 3 + → H 3 + + H 2 reactionGómez 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
4openAccessSanz-Sanz.pdf.jpg2013Full dimensional potential energy surface for the ground state of H 4 + system based on triatomic-in-molecules formalismSanz-Sanz, Cristina CSIC ORCID; Roncero, Octavio CSIC ORCID ; Paniagua, Miguel; Aguado, Alfredo CSIC ORCIDartículo
5openAccessSanz.pdf.jpg2011Infrared spectrum of H5 + and D5 +: The simplest shared-proton modelSanz-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 ORCIDartículo
6openAccessNear-resonant effects.pdf.jpg8-mar-2021Near-resonant effects in the quantum dynamics of the H + H 2 + → H 2 + H+charge transfer reaction and isotopic variantsSanz-Sanz, Cristina CSIC ORCID; Aguado, Alfredo CSIC ORCID; Roncero, Octavio CSIC ORCID artículo
7openAccessNon-adiabatic.pdf.jpg17-dic-2015Non-adiabatic couplings and dynamics in proton transfer reactions of H n + systems: Application to H 2 + H 2 + → H + H 3 + collisionsSanz-Sanz, Cristina CSIC ORCID; Aguado, Alfredo CSIC ORCID; Roncero, Octavio CSIC ORCID ; Naumkin, F.artículo
8openAccessDeuteration Reaction .pdf.jpg23-sep-2019Quantum Effects on the D + H 3 + → H2D+ + H Deuteration Reaction and Isotopic VariantsBulut, Niyazi; Aguado, Alfredo CSIC ORCID; Sanz-Sanz, Cristina CSIC ORCID; Roncero, Octavio CSIC ORCID artículo
9openAccessGonzalez.pdf.jpg2011Quantum stereodynamics of Li + HF reactive collisions: The role of reactants polarization on the differential cross sectionGonzález-Sánchez, Lola; Vasyutinskii, O.; Zanchet, Alexandre CSIC ORCID; Sanz-Sanz, Cristina CSIC ORCID; Roncero, Octavio CSIC ORCID artículo
10openAccessSanz.pdf.jpg29-dic-2011Quantum Zeno effect: quantum shuffling and MarkovianitySanz, Ángel S. CSIC ORCID; Sanz-Sanz, Cristina CSIC ORCID; González-Lezana, Tomás CSIC ORCID ; Roncero, Octavio CSIC ORCID ; Miret-Artés, Salvador CSIC ORCIDartículo
11openAccessAguado.pdf.jpg2012Simulation of the infrared predissociation spectra of H 5 +Aguado, Alfredo CSIC ORCID; Sanz-Sanz, Cristina CSIC ORCID; Villarreal, Pablo CSIC ORCID; Roncero, Octavio CSIC ORCID artículo
12openAccessThree states global fittings.pdf.jpg9-sep-2020Three states global fittings with improved long range: singlet and triplet states of H+3Aguado, Alfredo CSIC ORCID; Roncero, Octavio CSIC ORCID ; Sanz-Sanz, Cristina CSIC ORCIDartículo
13openAccessVibrational effects.pdf.jpg9-jul-2021Vibrational effects in the quantum dynamics of the H + D2+ charge transfer reactionRoncero, Octavio CSIC ORCID ; Andrianarijaona, V.; Aguado, A.; Sanz-Sanz, Cristina CSIC ORCIDartículo