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Analysis of trajectory similarity and configuration similarity in on-the-fly surface-hopping simulation on multi-channel nonadiabatic photoisomerization dynamics.
Li, Xusong; Hu, Deping; Xie, Yu; Lan, Zhenggang.
Affiliation
  • Li X; CAS Key Laboratory of Biobased Materials, Qingdao Institute of Bioenergy and Bioprocess Technology, Chinese Academy of Sciences, Qingdao 266101, China.
  • Hu D; CAS Key Laboratory of Biobased Materials, Qingdao Institute of Bioenergy and Bioprocess Technology, Chinese Academy of Sciences, Qingdao 266101, China.
  • Xie Y; The Environmental Research Institute, MOE Key Laboratory of Theoretical Chemistry of Environment, South China Normal University, Guangzhou 510006, China.
  • Lan Z; CAS Key Laboratory of Biobased Materials, Qingdao Institute of Bioenergy and Bioprocess Technology, Chinese Academy of Sciences, Qingdao 266101, China.
J Chem Phys ; 149(24): 244104, 2018 Dec 28.
Article in En | MEDLINE | ID: mdl-30599730
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Full text: 1 Collection: 01-internacional Database: MEDLINE Main subject: Biliverdine / Molecular Dynamics Simulation Language: En Journal: J Chem Phys Year: 2018 Document type: Article Affiliation country: China Country of publication: United States
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Full text: 1 Collection: 01-internacional Database: MEDLINE Main subject: Biliverdine / Molecular Dynamics Simulation Language: En Journal: J Chem Phys Year: 2018 Document type: Article Affiliation country: China Country of publication: United States