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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  
Selective Hydrodeoxygenation of Guaiacol to Phenolics by Ni/Anatase TiO2 Catalyst Formed by Cross-Surface Migration of Ni and TiO2 期刊论文
ACS CATALYSIS, 2019, 卷号: 9, 期号: 4, 页码: 3551-3563
Authors:  Zhang, Xiaoqiang;  Yan, Peifang;  Zhao, Bin;  Liu, Kairui;  Kung, Mayfair C.;  Kung, Harold H.;  Chen, Shanyong;  Zhang, Z. Conrad
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guaiacol hydrodeoxygenation  phenol  SMSI or strong metal-support interaction  titania and nickel  lignin  
Efficient and stable emission of warm-white light from lead-free halide double perovskites 期刊论文
NATURE, 2018, 卷号: 563, 期号: 7732, 页码: 541-+
Authors:  Luo, Jiajun;  Wang, Xiaoming;  Li, Shunran;  Liu, Jing;  Guo, Yueming;  Niu, Guangda;  Yao, Li;  Fu, Yuhao;  Gao, Liang;  Dong, Qingshun;  Zhao, Chunyi;  Leng, Meiying;  Ma, Fusheng;  Liang, Wenxi;  Wang, Liduo;  Jin, Shengye;  Han, Junbo;  Zhang, Lijun;  Etheridge, Joanne;  Wang, Jianbo;  Yan, Yanfa;  Sargent, Edward H.;  Tang, Jiang
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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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JOURNAL OF APPLIED SPECTROSCOPY, 2018, 卷号: 85, 期号: 5, 页码: 971-982
Authors:  Feng, L. Q.;  Castle, R. S.;  Feng, R.;  Liu, H.
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high-order harmonic generation  attosecond pulse generation  chirped pulse  spatial inhomogeneous field  
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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Engineering the porosity and acidity of H-Beta zeolite by dealumination for the production of 2-ethylanthraquinone via 2-(4 '-ethylbenzoyl)benzoic acid dehydration 期刊论文
RSC ADVANCES, 2018, 卷号: 8, 期号: 18, 页码: 9731-9740
Authors:  Liu, J. X.;  He, N.;  Liu, C. Y.;  Wang, G. R.;  Xin, Q.;  Guo, H. C.
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A full-dimensional time-dependent wave packet study of the H + CO2 -> OH plus CO reaction 期刊论文
CHEMICAL PHYSICS LETTERS, 2017, 卷号: 683, 页码: 352-356
Authors:  Sun, Peng;  Chen, Jun;  Liu, Shu;  Zhang, Dong H.
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