Literature DB >> 26274448

Full-Dimensional Quantum State-to-State Nonadiabatic Dynamics for Photodissociation of Ammonia in its A-Band.

Changjian Xie1, Jianyi Ma2,3, Xiaolei Zhu4, Dong Hui Zhang5, David R Yarkony4, Daiqian Xie1,6, Hua Guo2.   

Abstract

Entities:  

Keywords:  conical intersection; nonadiabatic transition; photodissociation; product state distribution; reaction dynamics

Year:  2014        PMID： 26274448     DOI： 10.1021/jz500227d

Source DB:  PubMed          Journal:  J Phys Chem Lett        ISSN： 1948-7185            Impact factor:   6.475


× No keyword cloud information.
  3 in total

1.  Beyond Kohn-Sham Approximation: Hybrid Multistate Wave Function and Density Functional Theory.

Authors:  Jiali Gao; Adam Grofe; Haisheng Ren; Peng Bao
Journal:  J Phys Chem Lett       Date:  2016-12-01       Impact factor: 6.475

2.  Effects of vibrational excitation on the F + H2O → HF + OH reaction: dissociative photodetachment of overtone-excited [F-H-OH].

Authors:  Amelia W Ray; Jianyi Ma; Rico Otto; Jun Li; Hua Guo; Robert E Continetti
Journal:  Chem Sci       Date:  2017-09-25       Impact factor: 9.825

3.  Coupled wave-packets for non-adiabatic molecular dynamics: a generalization of Gaussian wave-packet dynamics to multiple potential energy surfaces.

Authors:  Alexander White; Sergei Tretiak; Dmitry Mozyrsky
Journal:  Chem Sci       Date:  2016-04-25       Impact factor: 9.825
  3 in total

北京卡尤迪生物科技股份有限公司 © 2022-2023.