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CORC

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First-principles study of the impact of hydrogen on the adsorption properties of Ti-decorated graphdiyne storage methane 期刊论文
Chemical Physics Letters, 2022, 卷号: 790
作者:  Zhao, Qiuyu;  Chen, Yuhong;  Xu, Wenhui;  Ju, Jiaming;  Zhao, Yingjie
收藏  |  浏览/下载：17/0  |  提交时间：2022/04/21
First-Principles Study on Free Energy and Elastic Properties of Disordered beta-Ti1-xNbx Alloy: Comparison Between SQS and CPA 期刊论文
ACTA METALLURGICA SINICA, 2020, 卷号: 56, 期号: 9, 页码: 1304-1312
作者:  Zhang Haijun;  Qiu Shi;  Sun Zhimei;  Hu Qingmiao;  Yang Rui
收藏  |  浏览/下载：13/0  |  提交时间：2021/02/02
Effect of Co-Doping on the Stability of γ'-Ni3Al: A First-Principles Study 期刊论文
Xiyou Jinshu Cailiao Yu Gongcheng/Rare Metal Materials and Engineering, 2020, 卷号: 49, 期号: 8, 页码: 2746-2753
作者:  Li, Yamin;  Chen, Yinping;  Liu, Hongjun
收藏  |  浏览/下载：17/0  |  提交时间：2020/12/18
Effect of Co-Doping on the Stability of gamma '-Ni3Al: A First-Principles Study 期刊论文
RARE METAL MATERIALS AND ENGINEERING, 2020, 卷号: 49, 期号: 8, 页码: 2746-2753
作者:  Li Yamin;  Chen Yinping;  Liu Hongjun
收藏  |  浏览/下载：10/0  |  提交时间：2022/03/01
Effect of Cu/Al doping on electronic structure and optical properties of ZnO 期刊论文
RESULTS IN PHYSICS, 2019, 卷号: 15
作者:  Dai, Jianfeng;  Suo, Zhongqiang;  Li, Zengpeng;  Gao, Shanshan
收藏  |  浏览/下载：2/0  |  提交时间：2020/06/02
Bandgap control and optical properties of beta-Si3N4 by single- and co-doping from a first-principles simulation 期刊论文
INTERNATIONAL JOURNAL OF MODERN PHYSICS B, 2018, 卷号: 32, 期号: 14
作者:  Lu, Xuefeng;  Gao, Xu;  Ren, Junqiang;  Li, Cuixia;  Guo, Xin
收藏  |  浏览/下载：15/0  |  提交时间：2019/11/15
Modification of the photocatalytic properties of anatase TiO2 (101) surface by doping transition metals 期刊论文
ACTA PHYSICA SINICA, 2017, 卷号: 66, 期号: 6
作者:  Su Qiao-Zhi;  Han Qing-Zhen;  Gao Jin-Hua;  Wen Hao;  Jiang Zhao-Tan
收藏  |  浏览/下载：13/0  |  提交时间：2017/05/02
Atomistic simulation of the mechanical properties of beta-SiC based on the first-principles 期刊论文
Physica B: Condensed Matter, 2017, 卷号: 512, 页码: 1-5
作者:  Zhang RH(张仁辉);  Leng, Senlin;  Yang, Yingchang;  Shi, Wei;  Lu ZB(鲁志斌)
收藏  |  浏览/下载：32/0  |  提交时间：2017/05/10
Projector Augmented Wave Method Incorporated into Gauss-Type Atomic Orbital Based Density Functional Theory 期刊论文
JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2017, 卷号: 13, 期号: 7, 页码: 3236-3249
作者:  Xiong, XG;  Yanai, T
收藏  |  浏览/下载：15/0  |  提交时间：2018/08/30
Adsorption of TiO2 nanoparticles on monocrystalline silicon surface 期刊论文
Guangxue Jingmi Gongcheng/Optics and Precision Engineering, 2016, 卷号: 24, 期号: 7, 页码: 1694-1702
作者:  Song, Xiao-Zong;  Gao, Gui;  Zhou, You-Xin;  Wang, Hong-Gang;  Gong, Jun
收藏  |  浏览/下载：7/0  |  提交时间：2020/11/14

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