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Hydrogen diffusion on Fe surface and into subsurface from first principles 期刊论文
SURFACE SCIENCE, 2016, 卷号: 654, 页码: 48-55
作者:  Chen, Jun;  Liang, Tianshui;  Shen, Xiangjian;  Sun, Y. M.
收藏  |  浏览/下载:19/0  |  提交时间:2019/06/20
Catalytic decomposition of propellant N2O Over Ir/Al2O3 catalyst 期刊论文
AICHE JOURNAL, 2016, 卷号: 62, 期号: 11, 页码: 3973-3981
作者:  Wang, Xiaodong;  Lin, Jian;  Li, Lin;  Pan, Xiaoli;  Cong, Yu
收藏  |  浏览/下载:34/0  |  提交时间:2019/06/20
Rapid photocatalytic debromination on TiO2 with in-situ formed copper co-catalyst: Enhanced adsorption and visible light activity 期刊论文
APPLIED CATALYSIS B-ENVIRONMENTAL, 2016, 卷号: 194, 页码: 150-156
作者:  Lv, Yanhui;  Cao, Xiaofeng;  Jiang, Haiying;  Song, Wenjing;  Chen, Chuncheng
收藏  |  浏览/下载:15/0  |  提交时间:2017/01/18
; mechanisms of h2o and co2 formation from surface oxygen reduction on co(0001) 期刊论文
Journal of physical chemistry c, 2016, 卷号: 120, 期号: 34, 页码: 19265-19270
作者:  Liu, Shaoli;  Li, Yong-Wang;  Wang, Jianguo;  Jiao, Haijun
收藏  |  浏览/下载:27/0  |  提交时间:2019/05/09
Activation mechanisms of h-2, o-2, h2o, co2, co, ch4 and c2hx on metallic mo2c(001) as well as mo/c terminated mo2c(101) from density functional theory computations 期刊论文
Applied catalysis a-general, 2016, 卷号: 524, 页码: 223-236
作者:  Shi, Yun;  Yang, Yong;  Li, Yong-Wang;  Jiao, Haijun
收藏  |  浏览/下载:28/0  |  提交时间:2019/05/09
Co2  Co  C2hx  Ch4  H2o  Pbe-d3  Mo2c  
First Principles Study on the Adsorption of H-2 Molecules on LaFeO3 Surface 期刊论文
CHINESE JOURNAL OF INORGANIC CHEMISTRY, 2016, 卷号: 32, 期号: 6, 页码: 945-953
作者:  Chen Yu-Hong;  Pan Chang-Chang;  Zhang Mei-Ling;  Yuan Li-Hua;  Zhang Cai-Rong
收藏  |  浏览/下载:14/0  |  提交时间:2019/11/15
Quantum dynamics of water dissociative chemisorption on rigid Ni(111): An approximate nine-dimensional treatment 期刊论文
JOURNAL OF CHEMICAL PHYSICS, 2016, 卷号: 144, 期号: 16
作者:  Jiang, Bin;  Song, Hongwei;  Yang, Minghui;  Guo, Hua
收藏  |  浏览/下载:9/0  |  提交时间:2016/07/12
A seven-dimensional quantum dynamics study of the dissociative chemisorption of H2O on Cu(111): effects of azimuthal angles and azimuthal angle-averaging 期刊论文
CHEMICAL SCIENCE, 2016, 卷号: 7, 期号: 3, 页码: 1840-1845
作者:  Liu, Tianhui;  Zhang, Zhaojun;  Fu, Bina;  Yang, Xueming;  Zhang, Dong H.
收藏  |  浏览/下载:13/0  |  提交时间:2019/06/20
Molecular Nanocorrals on Si(111)-(7x7): Temperature-Dependent Site Selectivity 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY C, 2016
Mao, Wei; He, Jing Hui; Xi, Yong Jie; Chen, Wei; Wu, Kai; Zhang, Chun; Tok, Eng Soon; Xu, Guo Qin
收藏  |  浏览/下载:3/0  |  提交时间:2017/12/03
Water Adsorption and Dissociation on Ceria-Supported Single-Atom Catalysts: A First-Principles DFT plus U Investigation 期刊论文
CHEMISTRY-A EUROPEAN JOURNAL, 2016, 卷号: 22, 期号: 6, 页码: 2092—2099
作者:  Han, ZK;  Gao, Y
收藏  |  浏览/下载:15/0  |  提交时间:2016/09/12


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