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Search Publications by: Thomas C. Allison (Fed)

Displaying 26 - 31 of 31

Computational Study of the Reactions of Methane with XO Radicals (X = F, Cl, or Br): Implications in Combustion Chemistry

May 1, 2001

Author(s)

F Louis, Thomas C. Allison, Carlos A. Gonzalez, J P. Sawerysyn

Theoretical calculations were carried out on the H-atom abstraction reaction from methane by XO (X = F, Cl or Br) radicals attack. Geometry optimizations and vibrational frequency calculations were performed using three methods: Moller-Plesset second-order

Thermal and State-Selected Rate Coefficients for the O( 3 P) + HCl Reaction and New Calculations of the Barrier Height and Width

March 22, 2001

Author(s)

S. Skokov, S. L. Zou, Joel M. Bowman, Thomas C. Allison, D. G. Truhlar, Y. J. Lin, B. Ramachandran, B. C. Garrett, B. J. Lynch

Analysis of the Resonance in H+D 2 -> HD (N ' =3) + D

September 15, 2000

Author(s)

Thomas C. Allison, R S. Friedman, D J. Kaufman, D G. Truhlar