Quasi-Classical Trajectory Study of the N(2D) + H2(X1ΣG+) → NH(X3Σ–) + H(2S) Reaction Based on an Analytical Potential Energy Surface
Author:
Affiliation:
1. School of Physics and Optoelectronic Engineering, Ludong University, Yantai 264025, The People’s Republic of China
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/jp309197v
Reference32 articles.
1. Ab Initio Molecular Dynamics
2. Molecular potential-energy surfaces for chemical reaction dynamics
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1. Vibrational and rotational excitation effects of the N(2D) + D2(X1Σg +) → ND(X3Σ+) + D(2S) reaction;Molecular Physics;2018-02-21
2. A globally accurate potential energy surface of $$\mathrm{HS_2}{(A\,^2A^\prime )}$$ HS 2 ( A 2 A ′ ) and studies on the reaction dynamic of $$\mathrm{H}(^2\mathrm{S})+\mathrm{S_2}(a\,^1{\varDelta }_g)$$ H ( 2 S ) + S 2 ( a 1 Δ g );Theoretical Chemistry Accounts;2017-03
3. State-to-state quantum dynamics of N( 2 D) + HD ( υ = 0, j = 0) reaction;Chinese Physics B;2016-11-29
4. Reactive scattering of an electronically-excited nitrogen atom with H 2 and its isotopic variants:N(2D)+H2/D2/T2;Computational and Theoretical Chemistry;2016-04
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