Coordinate transformation methods to calculate state-to-state reaction probabilities with wave packet treatments S Gómez-Carrasco, O Roncero The Journal of chemical physics 125 (5), 2006 | 205 | 2006 |
Differential Cross Sections and Product Rotational Polarization in A + BC Reactions Using Wave Packet Methods: H+ + D2 and Li + HF Examples A Zanchet, O Roncero, T González-Lezana, A Rodríguez-López, ... The Journal of Physical Chemistry A 113 (52), 14488-14501, 2009 | 101 | 2009 |
Direct versus resonances mediated F+ OH collisions on a new A ″3 potential energy surface S Gómez-Carrasco, L González-Sánchez, A Aguado, O Roncero, ... The Journal of chemical physics 121 (10), 4605-4618, 2004 | 56 | 2004 |
Dynamics and kinetics of the F+ OH reaction on the ground triplet potential energy surface S Gómez-Carrasco, L González-Sánchez, A Aguado, M Paniagua, ... Chemical physics letters 383 (1-2), 25-30, 2004 | 52 | 2004 |
F+ OH reactive collisions on new excited A ″3 and A′ 3 potential-energy surfaces S Gómez-Carrasco, O Roncero, L González-Sánchez, ML Hernández, ... The Journal of chemical physics 123 (11), 2005 | 48 | 2005 |
Modeling the global potential energy surface of the N+ N 2 reaction from ab initio data E Garcia, A Saracibar, S Gómez-Carrasco, A Laganà Physical Chemistry Chemical Physics 10 (18), 2552-2558, 2008 | 44 | 2008 |
Photodetachment spectrum of OHF−: Three-dimensional study of the heavy–light–heavy resonances L González-Sánchez, S Gómez-Carrasco, A Aguado, M Paniagua, ... The Journal of chemical physics 121 (1), 309-320, 2004 | 44 | 2004 |
OH+ in astrophysical media: State-to-state formation rates, einstein coefficients and inelastic collision rates with He S Gómez-Carrasco, B Godard, F Lique, N Bulut, J Kłos, O Roncero, ... The Astrophysical Journal 794 (1), 33, 2014 | 42 | 2014 |
Quantum and quasiclassical state-selected O (1D)+ HF reaction dynamics and kinetics on a new MRCI ground singlet potential energy surface S Gomez-Carrasco, ML Hernández, JM Alvariño Chemical physics letters 435 (4-6), 188-193, 2007 | 42 | 2007 |
Dynamically biased statistical model for the ortho/para conversion in the H2+H3+ → H3++ H2 reaction S Gómez-Carrasco, L González-Sánchez, A Aguado, C Sanz-Sanz, ... The Journal of Chemical Physics 137 (9), 2012 | 41 | 2012 |
A Ring Polymer Molecular Dynamics Approach to Study the Transition between Statistical and Direct Mechanisms in the H2 + H3+ → H3+ + H2 Reaction YV Suleimanov, A Aguado, S Gómez-Carrasco, O Roncero The journal of physical chemistry letters 9 (9), 2133-2137, 2018 | 35 | 2018 |
Coupled diabatic potential energy surfaces for studying the nonadiabatic dynamics at conical intersections in angular resolved photodetachment simulations of OHF−→ OHF+ e− S Gómez-Carrasco, A Aguado, M Paniagua, O Roncero The Journal of chemical physics 125 (16), 2006 | 30 | 2006 |
Quantum stereodynamics of the F+ OH (v, j) reactive collision on the 13 A ″state L González-Sánchez, S Gómez-Carrasco, A Aguado, M Paniagua, ... Molecular Physics 102 (21-22), 2381-2392, 2004 | 28 | 2004 |
Transition state spectroscopy of open shell systems: Angle-resolved photodetachment spectra for the adiabatic singlet states of OHF S Gómez-Carrasco, A Aguado, M Paniagua, O Roncero Journal of Photochemistry and Photobiology A: Chemistry 190 (2-3), 145-160, 2007 | 27 | 2007 |
Nonadiabatic State-to-State Reactive Collisions among Open Shell Reactants with Conical Intersections: The OH(2Π) + F(2P) Example A Zanchet, T González-Lezana, A Aguado, S Gómez-Carrasco, ... The Journal of Physical Chemistry A 114 (36), 9733-9742, 2010 | 26 | 2010 |
State-to-state quantum wave packet dynamics of the LiH+ H reaction on two ab initio potential energy surfaces S Gómez-Carrasco, L González-Sánchez, N Bulut, O Roncero, L Banares, ... The Astrophysical Journal 784 (1), 55, 2014 | 17 | 2014 |
Transition state dynamics of OHF on several electronic states: Photodetachment spectrum of and conical intersections L González-Sánchez, S Gómez-Carrasco, A Aguado, M Paniagua, ... The Journal of chemical physics 121 (20), 9865-9875, 2004 | 17 | 2004 |
Ab initio study of the VUV-induced multistate photodynamics of formaldehyde S Gomez-Carrasco, T Muller, H Koppel The Journal of Physical Chemistry A 114 (43), 11436-11449, 2010 | 12 | 2010 |
DpgC‐Catalyzed Peroxidation of 3, 5‐Dihydroxyphenylacetyl‐CoA (DPA‐CoA): Insights into the Spin‐Forbidden Transition and Charge Transfer Mechanisms P Ortega, A Zanchet, C Sanz‐Sanz, S Gómez‐Carrasco, ... Chemistry–A European Journal 27 (5), 1700-1712, 2021 | 9 | 2021 |
Multi-state vibronic dynamics and multiple conical intersections HK S. Faraji, S. Gómez-Carrasco Conical Intersections: Theory, Computation and Experiment, 2012 | 9* | 2012 |