Reactive scattering using a mixed quantum-classical paradigm
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Reference33 articles.
1. Total integral reactive cross sections for F + H2 → HF + H: comparison of converged quantum, quasiclassical trajectory and experimental results
2. Differential cross section (angular distribution) for the reaction H+H2(v=j=0)→H2(v′, ODD j′)+H in the energy range 0.90-1.35 eV
3. Quantum reactive scattering via the S‐matrix version of the Kohn variational principle: Differential and integral cross sections for D+H2 →HD+H
4. Quantum-mechanical calculation of integral cross sections for the reaction F+H2(v=0, j=0)→FH(v′ j′)+H by the hyperspherical method
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1. Direct mixed-quantum/classical computations of k(T). An analysis of the use of different coordinate systems;International Journal of Quantum Chemistry;2010-08-31
2. Applications of Mixed-Quantum/Classical Trajectories to the Study of Nuclear Quantum Effects in Chemical Reactions and Vibrational Relaxation Processes;Advances in Quantum Chemistry;2010
3. The accuracy of the quantum/classical time-dependent self-consistent field treatment to reaction dynamics of large systems;Chemical Physics Letters;2004-01
4. Mixed quantum-classical study of energy transfer between H2O and a dipeptide;The Journal of Chemical Physics;2003-12
5. Quantum/classical studies of O(3P)+Ar⋅HCl collision dynamics;The Journal of Chemical Physics;2003-07-22
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