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Recent theoretical progress in the development of perovskite photovoltaic materials 期刊论文
Journal of Energy Chemistry, 2018, 卷号: Vol.27 No.3, 页码: 637-649
作者:  Xin Zhou;  Joanna Jankowska;  Hao Dong;  Oleg V. Prezhdo
收藏  |  浏览/下载：8/0  |  提交时间：2019/02/27
Theoretical investigation of loading Ni clusters on the α-GaO surfaces for photocatalytic hydrogen evolution 期刊论文
Journal of Energy Chemistry, 2018
作者:  Jiaxin Zhang;  Yidan Wang;  Hao Dong;  Xin Zhou
收藏  |  浏览/下载：4/0  |  提交时间：2019/02/27
Structure and catalytic activity of a newly proposed titanium species in a Ti-YNU-1 zeolite: a density functional theory study 期刊论文
Catalysis Science & Technology, 2017, 卷号: Vol.7 No.18, 页码: 4105-4114
作者:  Mengzhao Li;  Yichen Wang;  Yue Wu;  Meiqi Wang;  Danhong Zhou
收藏  |  浏览/下载：8/0  |  提交时间：2019/02/27
Aluminum Location and Acid Strength in an Aluminum-Rich Beta Zeolite Catalyst: A Combined Density Functional Theory and Solid-State NMR Study 期刊论文
ChemCatChem, 2017, 卷号: Vol.9 No.8, 页码: 1494-1502
作者:  Shikun Li;  Zhenchao Zhao;  Rongrong Zhao;  Danhong Zhou and Weiping Zhang
收藏  |  浏览/下载：2/0  |  提交时间：2019/02/27
Theoretical study of metal-doped β-GaO photocatalysts for overall water splitting 期刊论文
Theoretical Chemistry Accounts, 2017, 卷号: Vol.136 No.7
作者:  Xiaowei Qiu;  Jiaxin Zhang;  Hao Dong;  Xin Zhou
收藏  |  浏览/下载：3/0  |  提交时间：2019/02/27
Theoretical study of metal-doped β-GaO photocatalysts for overall water splitting. 期刊论文
Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2017, 卷号: Vol.136 No.7, 页码: 1-7
作者:  Qiu, Xiaowei;  Zhang, Jiaxin;  Dong, Hao;  Zhou, Xin
收藏  |  浏览/下载：3/0  |  提交时间：2019/02/27
Density Functional Theory Study of CO Adsorption in Amine-Functionalized Carbonaceous Materials 期刊论文
Acta Physico-Chimica Sinica, 2016, 卷号: Vol.32 No.7, 页码: 1666-1673
作者:  WANG, Juan;  LI, Shi-Kun;  ZHAO, Zhen-Chao;  ZHOU, Dan-Hong;  LU, An-Hui
收藏  |  浏览/下载：5/0  |  提交时间：2019/02/27
Tailoring the electronic structure of beta-Ga2O3 by non-metal doping from hybrid density functional theory calculations 期刊论文
Physical chemistry chemical physics, 2015, 卷号: Vol.17 No.8
作者:  Guo, Weiyan;  Guo, Yating;  Dong, Hao;  Zhou, Xin
收藏  |  浏览/下载：2/0  |  提交时间：2019/02/27
Tailoring the electronic structure of β-Ga2O3 by non-metal doping from hybrid density functional theory calculations. 期刊论文
Physical Chemistry Chemical Physics, 2015, 卷号: Vol.17 No.8, 页码: 5817-5825
作者:  Guo W;  Guo Y;  Dong H;  Zhou X.
收藏  |  浏览/下载：1/0  |  提交时间：2019/02/27
Structures and vibrational spectra of Ti-MWW zeolite upon adsorption of HO and NH: A density functional theory study 期刊论文
Chinese Journal of Catalysis, 2015, 卷号: Vol.36 No.10, 页码: 1733-1741
作者:  Yiming Qiao;  Zhilin Fan;  Yanjiao Jiang;  Na Li;  Hao Dong
收藏  |  浏览/下载：3/0  |  提交时间：2019/02/27

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