Publicaciones en colaboración con investigadores/as de Universitat de Barcelona (5)

2004

  1. Ab initio potential energy surface, variational transition state theory, and quasiclassical trajectory studies of the F+CH4?+HF+CH 3 reaction

    Journal of Chemical Physics, Vol. 120, Núm. 11, pp. 5181-5191

  2. Ab-initio analytical potential energy surface and quasiclassical trajectory study of the O+(4S) + H2 (X1Sigma+g) --> OH+(X 3Sigma-) + H (2S) reaction

    Journal of Chemical Physics, Vol. 120, Núm. 10, pp. 4705-4714

2003

  1. Ab initio study of the O(1D) + CH4(X1A1)?OH(X2?) + CH3(X2A?2) reaction: Ground and excited potential energy surfaces

    Journal of Chemical Physics, Vol. 119, Núm. 18, pp. 9504-9512

2002

  1. Ab initio, kinetics, and dynamics study of Cl+CH 4?HCl+CH 3

    Journal of Chemical Physics, Vol. 117, Núm. 12, pp. 5730-5741

1999

  1. Ab initio ground potential energy surface, VTST and QCT study of the O( 3P)+CH 4(X 1A 1)→OH(X 2∏)+CH 3(X 2A″ 2) reaction

    Journal of Chemical Physics, Vol. 110, Núm. 15, pp. 7326-7338