Funding Data Link References Status API Help
Page 1 of 20 results
Sort by: relevance publication year

Ab initio potential energy surface and quantum dynamics for the H + CH4 → H2 + CH3 reaction

Journal Article published 14 Feb 2011 in The Journal of Chemical Physics volume 134 issue 6 on page 064323

Research funded by National Natural Science Foundation of China (20833007, 90921014)

Authors: Yong Zhou, Bina Fu, Chunrui Wang, Michael A. Collins, Dong H. Zhang

Construction of diabatic energy surfaces for LiFH with artificial neural networks

Journal Article published 14 Dec 2017 in The Journal of Chemical Physics volume 147 issue 22 on page 224307

Research funded by National Natural Science Foundation of China (21433009, 21590800, 21688102)

Authors: Yafu Guan, Bina Fu, Dong H. Zhang

Trapped Abstraction in the O(1D) + CHD3 → OH + CD3 Reaction

Journal Article published 29 Aug 2014 in The Journal of Physical Chemistry Letters volume 5 issue 18 on pages 3106 to 3111

Research funded by National Natural Science Foundation of China

Authors: Jiayue Yang, Kejie Shao, Dong Zhang, Quan Shuai, Bina Fu, Dong H. Zhang, Xueming Yang

Recent advances in quantum scattering calculations on polyatomic bimolecular reactions

Journal Article published 2017 in Chemical Society Reviews volume 46 issue 24 on pages 7625 to 7649

Research funded by National Natural Science Foundation of China (21590804, 21433009, 21688102, 21673233, 21722307) | Chinese Academy of Sciences (XDB17000000) | Leverhulme Trust (RPG-2013-321)

Authors: Bina Fu, Xiao Shan, Dong H. Zhang, David C. Clary

Water dissociating on rigid Ni(100): A quantum dynamics study on a full-dimensional potential energy surface

Journal Article published 14 Apr 2018 in The Journal of Chemical Physics volume 148 issue 14 on page 144705

Research funded by National Natural Science Foundation of China (21703242, 21433009, 21722307, 21673233)

Authors: Tianhui Liu, Jun Chen, Zhaojun Zhang, Xiangjian Shen, Bina Fu, Dong H. Zhang

Validity of the site-averaging approximation for modeling the dissociative chemisorption of H2 on Cu(111) surface: A quantum dynamics study on two potential energy surfaces

Journal Article published 21 Nov 2014 in The Journal of Chemical Physics volume 141 issue 19 on page 194302

Research funded by National Natural Science Foundation of China (90921014 and 21303197)

Authors: Tianhui Liu, Bina Fu, Dong H. Zhang

Six-dimensional quantum dynamics study for the dissociative adsorption of DCl on Au(111) surface

Journal Article published 14 Apr 2014 in The Journal of Chemical Physics volume 140 issue 14 on page 144701

Research funded by National Natural Science Foundation of China (91221301)

Authors: Tianhui Liu, Bina Fu, Dong H. Zhang

Six-dimensional potential energy surfaces of the dissociative chemisorption of HCl on Ag(111) with three density functionals

Journal Article published 7 Aug 2018 in The Journal of Chemical Physics volume 149 issue 5 on page 054702

Research funded by National Natural Science Foundation of China (21703242, 21722307, 21673233, 21433009 and 21688102)

Authors: Tianhui Liu, Bina Fu, Dong H. Zhang

Full-dimensional quantum dynamics study of exchange processes for the D + H2O and D + HOD reactions

Journal Article published 21 May 2012 in The Journal of Chemical Physics volume 136 issue 19 on page 194301

Research funded by National Natural Science Foundation of China (20833007, 90921014)

Authors: Bina Fu, Dong H. Zhang

A full-dimensional quantum dynamics study of the mode specificity in the H + HOD abstraction reaction

Journal Article published 14 Feb 2015 in The Journal of Chemical Physics volume 142 issue 6 on page 064314

Research funded by National Natural Science Foundation of China (91221301 and 21303197)

Authors: Bina Fu, Dong H. Zhang