Test of Trajectory Surface Hopping Against Accurate Quantum Dynamics for an Electronically Nonadiabatic Chemical Reaction

This publication has 40 references indexed in Scilit:

• Validation of trajectory surface hopping methods against accurate quantum mechanical dynamics and semiclassical analysis of electronic-to-vibrational energy transfer
  The Journal of Chemical Physics, 1997
• Converged quantum-mechanical calculations of electronic-to-vibrational, rotational energy transfer probabilities in a system with a conical intersection
  Chemical Physics Letters, 1993
• A new diabatic representation of the coupled potential energy surfaces for Na(3p 2P)+H2→Na(3s 2S)+H2 or NaH+H
  The Journal of Chemical Physics, 1992
• Molecular dynamics with electronic transitions
  The Journal of Chemical Physics, 1990
• Dynamical basis sets for algebraic variational calculations in quantum-mechanical scattering theory
  Physical Review A, 1990
• An exact trajectory surface hopping procedure: Comparison with exact quantal calculations
  The Journal of Chemical Physics, 1989
• The effect of a conical intersection on cross sections for collision-induced dissociation
  The Journal of Chemical Physics, 1988
• Trajectory-surface-hopping study of Na(3p 2P) +H2 → Na(3s 2S)+H2(v′, j′, θ)
  The Journal of Chemical Physics, 1983
• Conditions for the definition of a strictly diabatic electronic basis for molecular systems
  The Journal of Chemical Physics, 1982
• Collisions Involving Electronic Transitions
  Published by American Chemical Society (ACS) ,1977