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Stability and Catalytic Performance of Single-Atom Catalysts Supported on Doped and Defective Graphene for CO2 Hydrogenation to Formic Acid: A First-Principles Study 期刊论文
ACS APPLIED NANO MATERIALS, 2021, 卷号: 4, 期号: 7, 页码: 6893-6902
作者:  Ali, Sajjad;  Iqbal, Rashid;  Khan, Azim;  Rehman, Shafiq Ur;  Haneef, Muhammad
收藏  |  浏览/下载:60/0  |  提交时间:2021/10/15
First-principles study of hydrogen trapping behavior in face centered cubic metals (M=Ni, Cu and Al) with monovacancy 期刊论文
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY, 2020, 卷号: 45, 期号: 46, 页码: 25555-25566
作者:  Xing, Weiwei;  Chen, Xing-Qiu;  Li, Xiaobing;  Ma, Yingche;  Chen, Bo
收藏  |  浏览/下载:124/0  |  提交时间:2021/02/02
The catalytic performance of metal-free defected carbon catalyst towards acetylene hydrochlorination revealed from first-principles calculation 期刊论文
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 2020, 页码: 8
作者:  Ali, Sajjad;  Khan, Muhammad Baber Azam;  Khan, Said Alam;  Noora
收藏  |  浏览/下载:22/0  |  提交时间:2021/02/02
Ab initio modeling of the formation and migration of monovacancies in Ti2AlC 期刊论文
Scripta Materialia, 2008, 卷号: 59, 期号: 8, 页码: 854-857
T. Liao; J. Y. Wang; Y. C. Zhou
收藏  |  浏览/下载:12/0  |  提交时间:2012/04/13
Defects and electron densities in TiAl-based alloys containing Mn and Cu studied by positron annihilation 期刊论文
Journal of Materials Science & Technology, 2003, 卷号: 19, 期号: 2, 页码: 164-166
W. Deng; D. K. Xiong; J. Y. Wang; L. Y. Xiong; M. Z. Cao; C. W. Lung
收藏  |  浏览/下载:15/0  |  提交时间:2012/04/14
Influence of chemical composition and alloying elements on microdefects and electron density in Ni-Al alloys 期刊论文
Transactions of Nonferrous Metals Society of China, 2002, 卷号: 12, 期号: 3, 页码: 370-374
W. Deng; Y. Y. Huang; D. H. Wu; L. Y. Xiong; S. H. Wang; J. T. Guo
收藏  |  浏览/下载:17/0  |  提交时间:2012/04/14
Investigation of annealing behavior of nanocrystalline NiAl 期刊论文
Materials & Design, 1997, 卷号: 18, 期号: 4-6, 页码: 373-377
L. Z. Zhou; J. T. Guo; G. S. Li; L. Y. Xiong; S. H. Wang; C. G. Li
收藏  |  浏览/下载:10/0  |  提交时间:2012/04/14
CALCULATIONS OF SELF-DIFFUSION ACTIVATION-ENERGIES FOR ALKALINE-METALS WITH EMBEDDED-ATOM METHOD 期刊论文
Science in China Series a-Mathematics Physics Astronomy & Technological Sciences, 1994, 卷号: 37, 期号: 10, 页码: 1232-1240
Y. F. Ouyang; B. W. Zhang; S. Z. Liao
收藏  |  浏览/下载:15/0  |  提交时间:2012/04/14
POSITRON-LIFETIME STUDY OF POLYCRYSTALLINE NI-P ALLOYS WITH ULTRAFINE GRAINS 期刊论文
Physical Review B, 1991, 卷号: 44, 期号: 12, 页码: 6466-6471
M. L. Sui; K. Lu; W. Deng; L. Y. Xiong; S. Patu; Y. Z. He
收藏  |  浏览/下载:9/0  |  提交时间:2012/04/14


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