화학공학소재연구정보센터
검색결과 : 28건
No. Article
1 Understanding chemical reactions within a generalized Hamilton-Jacobi framework (vol 478, pg 89, 2009)
Sanz AS, Gimenez X, Bofill JM, Miret-Artes S
Chemical Physics Letters, 488(4-6), 235, 2010
2 Understanding chemical reactions within a generalized Hamilton-Jacobi framework
Sanz AS, Gimenez X, Bofill JM, Miret-Artes S
Chemical Physics Letters, 478(1-3), 89, 2009
3 Bohmian Total Potential View to Quantum Effects III. Tunnelling in Phase Space
Gonzalez MF, Bofill JM, Gimenez X
Journal of Physical Chemistry A, 113(52), 15024, 2009
4 Quantum trajectories from a discrete - Variable representation method
Gonzalez MF, Gimenez X, Gonzalez-Aguilar J, Bofill JM
Journal of Physical Chemistry A, 111(41), 10226, 2007
5 On the implementation of the Runge-Kutta-Fehlberg algorithm to integrate intrinsic reaction coordinate paths
Aguilar-Mogas A, Gimenez X, Bofill J
Chemical Physics Letters, 432(1-3), 375, 2006
6 A Bohmian total potential view to quantum effects. I. Methodology and simple model systems
Gonzalez J, Bofill JM, Gimenez X
Journal of Chemical Physics, 120(23), 10961, 2004
7 Reactivity enhanced by under-barrier tunneling and resonances: the F+H-2 -> HF+H reaction
Aquilanti V, Cavalli S, De Fazio D, Volpi A, Aguilar A, Gimenez X, Lucas JM
Chemical Physics Letters, 371(3-4), 504, 2003
8 A reduced dimensionality QM study of the BO+H-2 -> HBO+H reaction: tunneling in polyatomic reactions
Szichman H, Gilibert M, Alberti M, Gimenez X, Aguilar A
Chemical Physics Letters, 353(5-6), 446, 2002
9 A reaction path Hamiltonian defined on a Newton path
Gonzalez J, Gimenez X, Bofill JM
Journal of Chemical Physics, 116(20), 8713, 2002
10 Semiclassical initial value representation description of molecular structure problems: An elongated dihydrogen ruthenium complex
Torres L, Gelabert R, Gimenez X, Moreno M, Lluch JM
Journal of Chemical Physics, 117(15), 7094, 2002