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The Journal of Physical Chemistry. A|May 15, 2010
Nonadiabatic state-to-state reactive collisions among open shell reactants with conical intersections: the OH((2)Pi) + F((2)P) exampleAlexandre Zanchet, Tomás González-Lezana, Alfredo Aguado, et al.
The Journal of Chemical Physics|September 15, 2011
Communication: theoretical exploration of Au(+)+H2, D2, and HD reactive collisionsAnaís Dorta-Urra, Alexandre Zanchet, Octavio Roncero, et al.
The Journal of Chemical Physics|January 3, 2013
The He + H2+ → HeH+ + H reaction: ab initio studies of the potential energy surface, benchmark time-independent quantum dynamics in an extended energy range and comparison with experimentsDario De Fazio, Miguel de Castro-Vitores, Alfredo Aguado, et al.
The Journal of Physical Chemistry Letters|April 3, 2019
Quantum Roaming in the Complex-Forming Mechanism of the Reactions of OH with Formaldehyde and Methanol at Low Temperature and Zero Pressure: A Ring Polymer Molecular Dynamics ApproachPablo Del Mazo-Sevillano, Alfredo Aguado, Elena Jiménez, et al.
The Journal of Chemical Physics|August 17, 2010
Toward a realistic density functional theory potential energy surface for the H5+ clusterPatricia Barragán, Rita Prosmiti, Octavio Roncero, et al.
ACS Earth & Space Chemistry|September 13, 2019
Zero- and high-pressure mechanisms in the complex forming reactions of OH with methanol and formaldehyde at low temperaturesFedor Naumkin, Pablo Del Mazo-Sevillano, Alfredo Aguado, et al.
Physical Chemistry Chemical Physics : PCCP|July 10, 2025
Understanding the destruction of CH<sup>+</sup> with atomic hydrogen at low temperatures: a non-adiabatic dynamical studyPablo Del Mazo-Sevillano, Alfredo Aguado, François Lique, et al.
Journal of Chemical Theory and Computation|November 19, 2015
Density-Difference-Driven Optimized Embedding Potential Method To Study the Spectroscopy of Br₂ in Water ClustersOctavio Roncero, Alfredo Aguado, Fidel A Batista-Romero, et al.
The Journal of Chemical Physics|September 11, 2012
Dynamically biased statistical model for the ortho/para conversion in the H2 + H3+ → H3+ + H2 reactionSusana Gómez-Carrasco, Lola González-Sánchez, Alfredo Aguado, et al.
Physical Chemistry Chemical Physics : PCCP|September 30, 2017
Full dimensional potential energy surface and low temperature dynamics of the H<sub>2</sub>CO + OH → HCO + H<sub>2</sub>O reactionAlexandre Zanchet, Pablo Del Mazo, Alfredo Aguado, et al.
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