Quantum dynamics study of the Cl+D2 reaction: Time-dependent wave packet calculations
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.1311799
Reference57 articles.
1. Absolute rate of the reaction of Cl(2P) with molecular hydrogen from 200–500 K
2. Kinetics of the Cl–H2 system. III. The deuterium isotope effect in Cl+H2
3. Thermal rate constants for the Cl+H2 and Cl+D2 reactions between 296 and 3000 K
4. Infrared frequency-modulation measurements of absolute rate coefficients for Cl+HD→HCl(DCl)+D(H) between 295 and 700 K
5. State-specific excitation function for Cl(2P)+H2 (v=0,j): Effects of spin-orbit and rotational states
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1. Effects of initial rotational quantum state excitations and thermal rate coefficient at room temperature for the $$\hbox {H}(^{2}\hbox {S}) + \hbox {NH}(\hbox {X}^{3}\Sigma ^{-}) \rightarrow \hbox {N}(^{4}\hbox {S}) + \hbox {H}_{2}(\hbox {X}^{1}\Sigma _{g}^{+})$$ H ( 2 S ) + NH ( X 3 Σ - ) → N ( 4 S ) + H 2 ( X 1 Σ g + ) reaction;Theoretical Chemistry Accounts;2016-03-23
2. The validities of centrifugal sudden approximations in chemical reaction dynamics;International Journal of Quantum Chemistry;2015-04-06
3. Reaction Dynamics and Mechanism of the Cl + HD(v = 1) Reaction: A Quantum Mechanical Study;The Journal of Physical Chemistry A;2013-03-27
4. Stereodynamics of chemical reactions: quasi-classical, quantum and mixed quantum-classical theories;Open Physics;2012-01-01
5. Higher-order split operator schemes for solving the Schrödinger equation in the time-dependent wave packet method: applications to triatomic reactive scattering calculations;Physical Chemistry Chemical Physics;2012
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