Mode specificity in the OH + CHD
3
reaction: Reduced-dimensional quantum and quasi-classical studies on an
ab initio
based full-dimensional potential energy surface

Mode specificity in the OH + CHD 3 reaction: Reduced-dimensional quantum and quasi-classical studies on an ab initio based full-dimensional potential energy surface

An initial state selected time-dependent wave packet method is applied to study the dynamics of the OH + CHD3 reaction with a six-dimensional model on a newly developed full-dimensional ab initio potential energy surface (PES). This quantum dynamical (QD) study is complemented by full-dimensional qu...

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書目詳細資料
Main Authors:	Yang, Minghui, Guo, Hua, Song, Hongwei, Lu, Yunpeng, Li, Jun
其他作者:	School of Physical and Mathematical Sciences
格式:	Article
語言:	English
出版:	2017
主題:	Trajectory Models Quantum Dots
在線閱讀:	https://hdl.handle.net/10356/86674 http://hdl.handle.net/10220/44127
標簽:	添加標簽沒有標簽, 成為第一個標記此記錄!
機構:	Nanyang Technological University
語言:	English

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