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An ab initio-based global potential energy surface for the SH3 system and full-dimensional state-to-state quantum dynamics study for the H-2 + HS -> H2S + H reaction 期刊论文
JOURNAL OF COMPUTATIONAL CHEMISTRY, 2019, 卷号: 40, 期号: 10, 页码: 1151-1160
Authors:  Xu, Xin;  Chen, Jun;  Liu, Shu;  Zhang, Dong H.
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potential energy surface  differential cross sections  H-2 + SH  quantum dynamics  time-dependent wave packet  
Mosquito's Compound Eyes as Inspiration for Fabrication of Conductive Superhydrophobic Nanocarbon Materials from Waste Wheat Straw 期刊论文
ACS SUSTAINABLE CHEMISTRY & ENGINEERING, 2019, 卷号: 7, 期号: 4, 页码: 3883-3894
Authors:  Wang, Yanbin;  Zhang, Dong;  Deng, June;  Zhou, Feng;  Duan, Zhiying;  Su, Qiong;  Pang, Shaofeng
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Biomimetic  Wheat straw  Controllable construction  Superhydrophobicity  Conductivity  Nanocarbon materials  
Room-temperature electrochemical water-gas shift reaction for high purity hydrogen production 期刊论文
NATURE COMMUNICATIONS, 2019, 卷号: 10, 页码: 8
Authors:  Cui, Xiaoju;  Su, Hai-Yan;  Chen, Ruixue;  Yu, Liang;  Dong, Jinchao;  Ma, Chao;  Wang, Suheng;  Li, Jianfeng;  Yang, Fan;  Xiao, Jianping;  Zhang, Mengtao;  Ma, Ding;  Deng, Dehui;  Zhang, Dong H.;  Tian, Zhongqun;  Bao, Xinhe
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Observation of the geometric phase effect in the H plus HD -> H-2 + D reaction 期刊论文
SCIENCE, 2018, 卷号: 362, 期号: 6420, 页码: 1289-+
Authors:  Yuan, Daofu;  Guan, Yafu;  Chen, Wentao;  Zhao, Hailin;  Yu, Shengrui;  Luo, Chang;  Tan, Yuxin;  Xie, Ting;  Wang, Xingan;  Sun, Zhigang;  Zhang, Dong H.;  Yang, Xueming
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Rate coefficients of the H + H2O2 -> H-2 + HO2 reaction on an accurate fundamental invariant-neural network potential energy surface 期刊论文
JOURNAL OF CHEMICAL PHYSICS, 2018, 卷号: 149, 期号: 17, 页码: 7
Authors:  Lu, Xiaoxiao;  Meng, Qingyong;  Wang, Xingan;  Fu, Bina;  Zhang, Dong H.
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Six-dimensional quantum dynamics for the dissociative chemisorption of HCl on rigid Ag(111) on three potential energy surfaces with different density functionals 期刊论文
JOURNAL OF CHEMICAL PHYSICS, 2018, 卷号: 149, 期号: 17, 页码: 8
Authors:  Liu, Tianhui;  Fu, Bina;  Zhang, Dong H.
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An accurate full-dimensional potential energy surface and quasiclassical trajectory dynamics of the H + H2O2 two-channel reaction 期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2018, 卷号: 20, 期号: 35, 页码: 23095-23105
Authors:  Lu, Xiaoxiao;  Shao, Kejie;  Fu, Bina;  Wang, Xingan;  Zhang, Dong H.
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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
Authors:  Chen, Jun;  Xu, Xin;  Liu, Shu;  Zhang, Dong H.
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Water dissociating on rigid Ni(100): A quantum dynamics study on a full-dimensional potential energy surface 期刊论文
JOURNAL OF CHEMICAL PHYSICS, 2018, 卷号: 148, 期号: 14
Authors:  Liu, Tianhui;  Chen, Jun;  Zhang, Zhaojun;  Shen, Xiangjian;  Fu, Bina;  Zhang, Dong H.
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Time-Dependent Wave Packet Dynamics Calculations of Cross Sections for Ultracold Scattering of Molecules 期刊论文
PHYSICAL REVIEW LETTERS, 2018, 卷号: 120, 期号: 14
Authors:  Huang, Jiayu;  Liu, Shu;  Zhang, Dong H.;  Krems, Roman V.
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