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A neural network potential energy surface for the F + CH4 reaction including multiple channels based on coupled cluster theory 期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2018, 卷号: 20, 期号: 14, 页码: 9090-9100
作者:  Xu, Xin;  Zhang, Dong H.;  Chen, Jun;  Liu, Shu
收藏  |  浏览/下载：14/0  |  提交时间：2019/06/20
Electronically excited-state properties and predissociation mechanisms of phosphorus monofluoride: A theoretical study including spin-orbit coupling 期刊论文
journal of chemical physics, 2012, 卷号: 137, 期号: 1
作者:  Yu, Le;  Bian, Wensheng
收藏  |  浏览/下载：16/0  |  提交时间：2015/11/09
A THEORETICAL ANALYSIS OF THE DISSOCIATION OF OH RADICAL: FINE-STRUCTURE DISTRIBUTIONS OF THE O(P-3(J)) PRODUCT 期刊论文
journal of theoretical & computational chemistry, 2011, 卷号: 10, 期号: 6, 页码: 747-767
作者:  Li, Yuanjun;  Zhang, Pei-Yu
收藏  |  浏览/下载：15/0  |  提交时间：2015/11/12
Time-dependent wavepacket investigation of state-to-state reactive scattering of Cl with para-H-2 including the open-shell character of the Cl atom 期刊论文
journal of chemical physics, 2010, 卷号: 132, 期号: 3
作者:  Sun, Zhigang;  Zhang, Dong H.;  Alexander, Millard H.
收藏  |  浏览/下载：31/0  |  提交时间：2015/11/12
Mixed Quantum-Classical Study of Nonadiabatic Dynamics in the O(P-3(2,1,0),D-1(2)) + H-2 Reaction 期刊论文
journal of physical chemistry a, 2009, 卷号: 113, 期号: 38, 页码: 10189-10195
作者:  Bin, Li;  Han, Ke-Li
收藏  |  浏览/下载：8/0  |  提交时间：2015/11/12
A quantum wave-packet study of intersystem crossing effects in the O(P-3(2,1,0),D-1(2))+H-2 reaction 期刊论文
journal of chemical physics, 2005, 卷号: 122, 期号: 21
作者:  Chu, TS;  Zhang, X;  Han, KL
收藏  |  浏览/下载：11/0  |  提交时间：2015/11/10
Nonadiabatic energy transfer studies of O(D-1)+N-2(X (1)Sigma(+)(g))-> O(P-3)+N-2(X (1)Sigma(+)(g)) by time-dependent wave packet 期刊论文
journal of chemical physics, 2004, 卷号: 121, 期号: 19, 页码: 9352-9360
作者:  Chu, TS;  Xie, TX;  Han, KL
收藏  |  浏览/下载：21/0  |  提交时间：2015/11/10

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