화학공학소재연구정보센터
검색결과 : 34건
No. Article
1 Accurate Time-Dependent Wave Packet Calculations for the O+ + H-2 -> OH+ + H Ion-Molecule Reaction
Bulut N, Castillo JF, Jambrina PG, Klos J, Roncero O, Aoiz FJ, Banares L
Journal of Physical Chemistry A, 119(50), 11951, 2015
2 Accurate Time-Dependent Wave Packet Study of the Li + H-2(+) Reaction and Its Isotopic Variants
Aslan E, Bulut N, Castillo JF, Banares L, Roncero O, Aoiz FJ
Journal of Physical Chemistry A, 116(1), 132, 2012
3 Preparation and characterization of Ce0.95Zr0.05O2 nanopowders obtained by sol-gel and template methods
Isasi J, Perez M, Castillo JF, Correcher V, Aldama I, Arevalo P, Carbajo MC
Materials Chemistry and Physics, 136(1), 160, 2012
4 Quantum Mechanical Wave Packet and Quasiclassical Trajectory Calculations for the Li + H-2(+) Reaction
Bulut N, Castillo JF, Banares L, Aoiz FJ
Journal of Physical Chemistry A, 113(52), 14657, 2009
5 Quasiclassical trajectory study of the collision-induced dissociation dynamics of Ar+CH3SH+ using an ab initio interpolated potential energy surface
Martinez-Nunez E, Vazquez SA, Aoiz FJ, Castillo JF
Journal of Physical Chemistry A, 110(4), 1225, 2006
6 On the conformational memory in the photodissociation of formic acid
Martinez-Nunez E, Vazquez SA, Borges I, Rocha AB, Estevez CM, Castillo JF, Aoiz FJ
Journal of Physical Chemistry A, 109(12), 2836, 2005
7 Quasiclassical trajectory study of the F+CH4 reaction dynamics on a dual-level interpolated potential energy surface
Castillo JF, Aoiz FJ, Banares L, Martinez-Nunez E, Fernandez-Ramos A, Vazquez S
Journal of Physical Chemistry A, 109(38), 8459, 2005
8 Further investigation of the HCl elimination in the photodissociation of vinyl chloride at 193 nm: a direct MP2/6-31G(d,p) trajectory study
Martinez-Nunez E, Vazquez SA, Aoiz FJ, Banares L, Castillo JF
Chemical Physics Letters, 386(4-6), 225, 2004
9 Disagreement between theory and experiment in the simplest chemical reaction: Collision energy dependent rotational distributions for H+D-2 -> HD(nu(')=3,j('))+D
Pomerantz AE, Ausfelder F, Zare RN, Althorpe SC, Aoiz FJ, Banares L, Castillo JF
Journal of Chemical Physics, 120(7), 3244, 2004
10 Collision energy dependence of the HD(nu(')=2) product rotational distribution of the H+D-2 reaction in the range 1.30-1.89 eV
Ausfelder F, Pomerantz AE, Zare RN, Althorpe SC, Aoiz FJ, Banares L, Castillo JF
Journal of Chemical Physics, 120(7), 3255, 2004