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Origin of the distinct site occupations of H atom in hcp Ti and Zr/Hf 期刊论文
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY, 2024, 卷号: 91, 页码: 933-941
作者:  Yang, Fan-Xi;  Zhu, Yi-Fei;  Cao, Shuo;  Wang, Chao-Ming;  Ma, Ying-Jie;  Yang, Rui;  Hu, Qing-Miao
收藏  |  浏览/下载：2/0  |  提交时间：2025/04/27
hcp metals  Hydrogen embrittlement  Hydrogen storage  DFT calculations  Site occupation of H  
A Computation-Guided Design of Highly Defined and Dense Bimetallic Active Sites on a Two-Dimensional Conductive Metal-Organic Framework for Efficient H2O2 Electrosynthesis 期刊论文
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 2024, 页码: 10
作者:  Li, Zhenxin;  Jia, Jingjing;  Sang, Zhiyuan;  Liu, Wei;  Nie, Jiahuan;  Yin, Lichang;  Hou, Feng;  Liu, Jiachen;  Liang, Ji
收藏  |  浏览/下载：1/0  |  提交时间：2025/04/27
conductive metal-organic frameworks  multi-site catalysts  two-electron oxygen reduction reaction  hydrogen peroxide  
Site preference of the 3d transition metal ions in the Mn4-xFexNb2O9 compounds as revealed by M?ssbauer spectroscopy 期刊论文
JOURNAL OF MAGNETISM AND MAGNETIC MATERIALS, 2024, 卷号: 594, 页码: 7
作者:  Zhang, Bo;  Xue, Jijun;  Cao, Yantao;  Kuang, Qifeng;  Li, Da;  Guo, Hanjie;  Li, ZhenHua;  Tang, Liyun;  Pang, Hua;  Li, Fashen;  Li, Zhiwei
收藏  |  浏览/下载：2/0  |  提交时间：2025/04/27
Site preference  Mossbauer spectroscopy  DFT calculation  Band mixing behavior  
Interstitial Carbon in Ni Enables High-Efficiency Hydrogenation of 1,3-Butadiene 期刊论文
ACTA PHYSICO-CHIMICA SINICA, 2023, 卷号: 39, 期号: 10, 页码: 7
作者:  Dong, Shaoming;  Pu, Yinghui;  Niu, Yiming;  Zhang, Lei;  Wang, Yongzhao;  Zhang, Bingsen
收藏  |  浏览/下载：12/0  |  提交时间：2024/01/08
Ni-based catalyst  Interstitial site  Ni3ZnC0.7  Selective hydrogenation  Subsurface carbon  
Study on the Tribological Behavior and the Interaction between Friction and Oxidation of Graphite Reinforced by Impregnated Phosphate at High Temperatures 期刊论文
MATERIALS, 2023, 卷号: 16, 期号: 9, 页码: 19
作者:  Cheng, Hao;  Gao, Siyang;  Duan, Deli;  Yang, Shuai;  Xue, Weihai;  Wu, Bi;  Zhu, Zhenguo
收藏  |  浏览/下载：5/0  |  提交时间：2024/01/07
impregnated graphite  zinc phosphate  high-temperature  wear  oxidation  inert site  
On the sulfide stress cracking resistance of a 125 ksi grade high-strength low-alloyed steel for oil country tubular goods 期刊论文
CORROSION SCIENCE, 2022, 卷号: 209, 页码: 14
作者:  Zeng, T. Y.;  Zhang, S. Z.;  Shi, X. B.;  Wang, W.;  Yan, W.;  Yang, K.
收藏  |  浏览/下载：48/0  |  提交时间：2023/05/09
SSC resistance  Tempered martensite  Cu alloying  H-trapping site  Oil country tubular goods  
Theoretical study on site preference of Mn in B-containing Ni3Al alloys and elastic properties 期刊论文
MATERIALS TODAY COMMUNICATIONS, 2022, 卷号: 33, 页码: 9
作者:  Liu, Lili;  Liu, Yajuan;  Gao, Tianfu;  Li, Chunmei;  Hou, Jieshan;  Huang, Renzhong
收藏  |  浏览/下载：65/0  |  提交时间：2023/05/09
Ni3Al alloys  First-principles  Site preference  Elastic properties  
Non-magnetic ion site disorder effects on the quantum magnetism of a spin-1/2 equilateral triangular lattice antiferromagnet 期刊论文
JOURNAL OF PHYSICS-CONDENSED MATTER, 2022, 卷号: 34, 期号: 20, 页码: 10
作者:  Huang, Q.;  Rawl, R.;  Xie, W. W.;  Chou, E. S.;  Zapf, V. S.;  Ding, X. X.;  Mauws, C.;  Wiebe, C. R.;  Feng, E. X.;  Cao, H. B.;  Tian, W.;  Ma, J.;  Qiu, Y.;  Butch, N.;  Zhou, H. D.
收藏  |  浏览/下载：111/0  |  提交时间：2022/07/01
geometrically frustrated magnet  site disorder  phase transitions  

Clarifying the critical roles of iron in boosting oxygen reduction: Single Fe atoms anchored on carbon vacancies as efficient active sites

 期刊论文
APPLIED CATALYSIS B-ENVIRONMENTAL, 2022, 卷号: 305, 页码: 11
作者:  Tan, Feng;  Li, Wei;  Wang, Jingsong;  Min, Chungang;  Li, Zhanping;  Zhang, Bingsen;  Zheng, Xusheng;  Li, Lina;  Zhang, Longzhou;  Zhou, Liexing;  Shi, Qingnan;  Yang, Xikun
收藏  |  浏览/下载：117/0  |  提交时间：2022/07/01
Structurally-defined precursor  Single iron atom  Carbon vacancy  Catalytic active site  Oxygen reduction reaction  
Engineering the Active Sites of Graphene Catalyst: From CO2 Activation to Activate Li-CO2 Batteries 期刊论文
ACS NANO, 2021, 卷号: 15, 期号: 6, 页码: 9841-9850
作者:  Chen, Biao;  Wang, Dashuai;  Zhang, Biao;  Zhong, Xiongwei;  Liu, Yingqi;  Sheng, Jinzhi;  Zhang, Qi;  Zou, Xiaolong;  Zhou, Guangmin;  Cheng, Hui-Ming
收藏  |  浏览/下载：130/0  |  提交时间：2021/10/15
graphene  nitrogen configuration  active site  CO2 activation  Li-CO2 batteries