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First-principles study on the electronic structure of Pb10-xCux(PO4)6O ( x=0, 1) 期刊论文
JOURNAL OF MATERIALS SCIENCE & TECHNOLOGY, 2024, 卷号: 171, 页码: 66-70
作者:  Lai, Junwen;  Li, Jiangxu;  Liu, Peitao;  Sun, Yan;  Chen, Xing-Qiu
收藏  |  浏览/下载:5/0  |  提交时间:2024/01/08
First-principles calculations  Density functional theory  Electronic structure  Superconductivity  Flat bands  Strongly correlated electrons  
Optimizing the electronic structure of Fe-doped Co 3 O 4 supported Ru catalyst via metal-support interaction boosting oxygen evolution reaction and hydrogen evolution reaction 期刊论文
CHINESE CHEMICAL LETTERS, 2023, 卷号: 34, 期号: 9, 页码: 5
作者:  Gao, Li;  Zhong, Xia;  Chen, Junnan;  Zhang, Ying;  Liu, Jie;  Zhang, Bingsen
收藏  |  浏览/下载:3/0  |  提交时间:2024/01/08
Metal-support interaction  Fe doping  Electronic structure  OER  HER  
Design of anti-mildew smart microcapsules with chitosan as encapsulant for advanced electronic packaging epoxy coating 期刊论文
PROGRESS IN ORGANIC COATINGS, 2023, 卷号: 180, 页码: 12
作者:  Li, Bowen;  Ma, Yuantai;  Njoku, Demian;  Meng, Meijiang;  Tang, Ao;  Li, Ying
收藏  |  浏览/下载:7/0  |  提交时间:2024/01/07
Smart microcapsule  Halloysite clay nanotubes  Chitosan  Dual -pH sensitive  Electronic packaging coating  Anti -mildew  
Effect of doping concentration on the antiferromagnetic transition temperature of multiferroic YMnO3: A first-principles study 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2023, 卷号: 218, 页码: 5
作者:  Chen, D.;  Wang, Y. J.;  Zhu, Y. L.;  Ma, X. L.
收藏  |  浏览/下载:63/0  |  提交时间:2023/05/09
First-principles  Concentration  Electronic structure  Magnetic property  HexagonalYMnO3  
Comprehensive understanding of local lattice distortion in dilute and equiatomic FCC alloys 期刊论文
MATERIALS CHEMISTRY AND PHYSICS, 2023, 卷号: 293, 页码: 11
作者:  Liu, Wei;  Lu, Xiao-Gang;  Hu, Qing-Miao
收藏  |  浏览/下载:28/0  |  提交时间:2023/05/09
High -entropy alloys  Local lattice distortion  Size factor  Electronic factor  Magnetism  
Influence of different temperatures on morphology and chemical state of the surface-active layer of scandium-tungsten cathode 期刊论文
INTERNATIONAL JOURNAL OF REFRACTORY METALS & HARD MATERIALS, 2022, 卷号: 108, 页码: 9
作者:  Cheng, Yin;  Wang, ShiYang;  Sun, Yuan;  Yang, YanHong;  Zhou, YiZhou
收藏  |  浏览/下载:105/0  |  提交时间:2022/09/16
Electronic materials  Active layer  Valence states  Work function  Scandium-tungsten (Sc-W) cathodes  
Accelerating CO2 reduction on novel double perovskite oxide with sulfur, carbon incorporation: Synergistic electronic and chemical engineering 期刊论文
CHEMICAL ENGINEERING JOURNAL, 2022, 卷号: 446, 页码: 11
作者:  Raziq, Fazal;  Khan, Khakemin;  Ali, Sajjad;  Ali, Sharafat;  Xu, Hu;  Ali, Ijaz;  Zada, Amir;  Ismail, Pir Muhammad;  Ali, Asad;  Khan, Habib;  Wu, Xiaoqiang;  Kong, Qingquan;  Zahoor, Muhammad;  Xiao, Haiyan;  Zu, Xiaotao;  Li, Sean;  Qiao, Liang
收藏  |  浏览/下载:133/0  |  提交时间:2022/07/14
CO 2 conversion  Chemical engineering  Electronic engineering  Novel double perovskite  Density functional theory  
Theoretical design of BAs/WX2 (X = S, Se) heterostructures for high-performance photovoltaic applications from DFT calculations 期刊论文
APPLIED SURFACE SCIENCE, 2022, 卷号: 599, 页码: 11
作者:  Guan, Yue;  Li, Xiaodan;  Hu, Qingmiao;  Zhao, Dandan;  Zhang, Lin
收藏  |  浏览/下载:120/0  |  提交时间:2022/09/16
First principle calculations  2D materials  Heterojunction  Electronic structure  Electric field  Photovoltaic applications  
Perovskite enables high performance vanadium redox flow battery 期刊论文
CHEMICAL ENGINEERING JOURNAL, 2022, 卷号: 443, 页码: 8
作者:  Jiang, Yingqiao;  Liu, Zihe;  Lv, Yanrong;  Tang, Ao;  Dai, Lei;  Wang, Ling;  He, Zhangxing
收藏  |  浏览/下载:117/0  |  提交时间:2022/07/14
Vanadium redox flow battery  Perovskite  Electronic structure  P-band center  Composite electrode  
Thermally stable carbon-coated SiC/polydimethylsiloxane nanocomposites for EMI shielding in the terahertz range 期刊论文
MATERIALS RESEARCH BULLETIN, 2022, 卷号: 153, 页码: 9
作者:  Huang, Feirong;  Fan, Shuting;  Tian, Yuqi;  Qu, Xinghao;  Li, Xiyang;  Javid, Muhammad;  Zhang, Xuefeng;  Zhang, Zhidong;  Dong, Xinglong;  Cao, Tun;  Park, Sung Jin
收藏  |  浏览/下载:140/0  |  提交时间:2022/09/16
ceramics  nanostructures  composites  electronic materials  thermodynamic properties