Octavio Roncero
Octavio Roncero
Instituto de Física Fundamental, CSIC
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A comparison of different propagation schemes for the time dependent Schrödinger equation
C Leforestier, RH Bisseling, C Cerjan, MD Feit, R Friesner, A Guldberg, ...
Journal of Computational Physics 94 (1), 59-80, 1991
Vector properties in photodissociation: Quantum treatment of the correlation between the spatial anisotropy and the angular momentum polarization of the fragments
LDA Siebbeles, M Glass‐Maujean, OS Vasyutinskii, JA Beswick, ...
The Journal of chemical physics 100 (5), 3610-3623, 1994
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), 054102, 2006
Global potential energy surfaces for the H+ 3 system. Analytical representation of the adiabatic ground-state 1 ^1A′ potential
A Aguado, O Roncero, C Tablero, C Sanz, M Paniagua
Journal of Chemical Physics 112, 1240-1254, 2000
O Roncero, JA Beswick, N Halberstadt, P Villarreal, G Delgado-Barrio
J. Chem. Phys 92, 3348, 1990
An inversion technique for the calculation of embedding potentials
O Roncero, MP de Lara-Castells, P Villarreal, F Flores, J Ortega, ...
The Journal of chemical physics 129 (18), 184104, 2008
Quantum study of the Li+ HF→ LiF+ H reaction
A Aguado, M Paniagua, M Lara, O Roncero
The Journal of chemical physics 107 (23), 10085-10095, 1997
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
Vibrational predissociation of the Ar-Cl2 van der Waals complex: The small molecule limit for intramolecular vibrational redistribution
N Halberstadt, S Serna, O Roncero, KC Janda
J. Chem. Phys 97, 341, 1992
Potential energy surface and wave packet calculations on the Li+HFLiF+H reaction
A Aguado, M Paniagua, M Lara, O Roncero
The Journal of chemical physics 106 (3), 1013-1025, 1997
A detailed quantum mechanical and quasiclassical trajectory study on the dynamics of the H+ +H2→ H+ +H2 exchange reaction
T González-Lezana, O Roncero, P Honvault, JM Launay, N Bulut, FJ Aoiz, ...
The Journal of chemical physics 125, 094314, 2006
Energy levels and structure of tetra‐atomic van der Waals clusters
P Villarreal, O Roncero, G Delgado‐Barrio
The Journal of chemical physics 101 (3), 2217-2230, 1994
Quantum stereodynamics of the reactive collision for different initial states of the reagent
M Lara, A Aguado, O Roncero, M Paniagua
The Journal of chemical physics 109 (21), 9391-9400, 1998
A new accurate and full dimensional potential energy surface of H5+ based on a triatomics-in-molecules analytic functional form
A Aguado, P Barragán, R Prosmiti, G Delgado-Barrio, P Villarreal, ...
The Journal of chemical physics 133, 024306, 2010
H2 (v= 0, 1)+ C+ (2P)→ H+ CH+ state-to-state rate constants for chemical pumping models in astrophysical media
A Zanchet, B Godard, N Bulut, O Roncero, P Halvick, J Cernicharo
The Astrophysical Journal 766 (2), 80, 2013
Quantum approaches for the insertion dynamics of the H+ +D2 and D+ +H2 reactive collisions
T González-Lezana, A Aguado, M Paniagua, O Roncero
The Journal of chemical physics 123, 194309, 2005
Ar··· I 2: A model system for complex dynamics
A Buchachenko, N Halberstadt, B Lepetit, O Roncero
International Reviews in Physical Chemistry 22 (1), 153-202, 2003
State-to-state reaction probabilities using bond coordinates: Application to the collision
M Lara, A Aguado, M Paniagua, O Roncero
The Journal of Chemical Physics 113 (5), 1781-1794, 2000
On the dynamics of the H+ +D2 (v= 0, j= 0)→ HD+ D+ reaction: A comparison between theory and experiment
E Carmona-Novillo, T González-Lezana, O Roncero, P Honvault, ...
The Journal of chemical physics 128, 014304, 2008
Ionization fraction and the enhanced sulfur chemistry in Barnard 1
A Fuente, J Cernicharo, E Roueff, M Gerin, J Pety, N Marcelino, ...
Astronomy & Astrophysics 593, A94, 2016
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