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- Quasi-classical trajectory calculations in asymmetrically substituted polyatomic systems of the type A + CX3Y --> products: the H + CH3Cl hydrogen abstraction reaction channel.[Phys Chem Chem Phys. 2008]Quasi-classical trajectory calculations in asymmetrically substituted polyatomic systems of the type A + CX3Y --> products: the H + CH3Cl hydrogen abstraction reaction channel.
*Rangel C, Corchado JC, Espinosa-García J.**Phys Chem Chem Phys. 2008 Dec 7; 10(45):6776-86. Epub 2008 Sep 30.* - Quasi-classical trajectory study of the F + CD4 reaction dynamics.[J Phys Chem A. 2007]Quasi-classical trajectory study of the F + CD4 reaction dynamics.
*Espinosa-García J.**J Phys Chem A. 2007 May 10; 111(18):3497-501. Epub 2007 Apr 14.* - Role of the C-H stretch mode excitation in the dynamics of the Cl + CHD3 reaction: a quasi-classical trajectory calculation.[J Phys Chem A. 2007]Role of the C-H stretch mode excitation in the dynamics of the Cl + CHD3 reaction: a quasi-classical trajectory calculation.
*Espinosa-García J.**J Phys Chem A. 2007 Oct 4; 111(39):9654-61. Epub 2007 Sep 8.* - Quasi-classical trajectory calculations analyzing the dynamics of the C-H stretch mode excitation in the H+CHD3 reaction.[J Phys Chem A. 2007]Quasi-classical trajectory calculations analyzing the dynamics of the C-H stretch mode excitation in the H+CHD3 reaction.
*Espinosa-García J.**J Phys Chem A. 2007 Jul 5; 111(26):5792-9. Epub 2007 Jun 14.* - Quasi-classical trajectory calculations analyzing the reactivity and dynamics of asymmetric stretch mode excitations of methane in the H + CH4 reaction.[J Phys Chem A. 2006]Quasi-classical trajectory calculations analyzing the reactivity and dynamics of asymmetric stretch mode excitations of methane in the H + CH4 reaction.
*Rangel C, Corchado JC, Espinosa-García J.**J Phys Chem A. 2006 Sep 7; 110(35):10375-83.*