NH(X3Σ)+H/D(S2)→H(S2)+NH/ND(X3Σ) exchange reactions: State-to-state quantum scattering and applicability of statistical model

Comparison of second-order split operator and Chebyshev propagator in wave packet based state-to-state reactive scattering calculations

(2009) Zhigang Sun et al.   JOURNAL OF CHEMICAL PHYSICS

On the statistical behavior of the O+OH→H+O[sub 2] reaction: A comparison between quasiclassical trajectory, quantum scattering, and statistical calculations

(2009) Mohamed Jorfi et al.   JOURNAL OF CHEMICAL PHYSICS

A Reactant-Coordinate-Based Time-Dependent Wave Packet Method for Triatomic State-to-State Reaction Dynamics: Application to the H + O2Reaction†

(2009) Zhigang Sun et al.   JOURNAL OF PHYSICAL CHEMISTRY A

A new ab initio potential-energy surface for NH2(XA″2) and quantum studies of NH2 vibrational spectrum and rate constant for the N(D2)+H2→NH+H reaction

(2008) Shulan Zhou et al.   JOURNAL OF CHEMICAL PHYSICS

A comparison of quantum and quasiclassical statistical models for reactions of electronically excited atoms with molecular hydrogen

(2008) F. J. Aoiz et al.   JOURNAL OF CHEMICAL PHYSICS

Study of the H+O2 reaction by means of quantum mechanical and statistical approaches: The dynamics on two different potential energy surfaces

(2008) Pedro Bargueño et al.   JOURNAL OF CHEMICAL PHYSICS