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Conduction band engineering of half-Heusler thermoelectrics using orbital chemistry 期刊论文
JOURNAL OF MATERIALS CHEMISTRY A, 2021
作者:  Guo, Shuping;  Anand, Shashwat;  Brod, Madison K.;  Zhang, Yongsheng;  Snyder, G. Jeffrey
收藏  |  浏览/下载:22/0  |  提交时间:2022/02/14
Excited States Symmetry Breaking and In-Plane Polarization Cause Chiral Reversal in Diastereomers 期刊论文
Molecules, 2021, 卷号: 26, 期号: 15, 页码: 15
作者:  C. L. Wang;  J. G. Wang and C. Y. Wang
收藏  |  浏览/下载:2/0  |  提交时间:2022/06/13
Electric field induced injection and shift currents in zigzag graphene nanoribbons 期刊论文
Physical Review B, 2021, 卷号: 104, 期号: 11
作者:  Y. Wei;  W. Li;  Y. Jiang and J. Cheng
收藏  |  浏览/下载:4/0  |  提交时间:2022/06/13
Understanding Superatomic Ag Nanohydrides 期刊论文
SMALL, 2021, 卷号: 17, 期号: 27
作者:  He, Xiang;  Walter, Michael;  Jiang, De-en
收藏  |  浏览/下载:13/0  |  提交时间:2022/03/10
Three-dimensional stacking of canted antiferromagnetism and pseudospin current in undoped Sr2IrO4: Symmetry analysis and microscopic model realization 期刊论文
PHYSICAL REVIEW B, 2021, 卷号: 104, 期号: 16, 页码: 165145
作者:  Huang, Yun-Peng;  Dong, Jin-Wei;  Wang, Ziqiang;  Zhou, Sen
收藏  |  浏览/下载:2/0  |  提交时间:2023/01/16
Inhomogeneities of charge distribution in porous graphitic carbon nitride g-CxNy nanosheets 期刊论文
European Physical Journal D, 2020, 卷号: 74, 期号: 12
作者:  Liang, Zefen;  He, Tianxiang;  Xue, Hongtao;  Tang, Fuling;  Fan, Ding
收藏  |  浏览/下载:11/0  |  提交时间:2022/02/18
The Moving-Grid Effect in the Harmonic Vibrational Frequency Calculations with Numeric Atom-Centered Orbitals 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY A, 2020, 卷号: 124, 期号: 14, 页码: 2897-2906
作者:  Shang, Honghui;  Yang, Jinlong
收藏  |  浏览/下载:2/0  |  提交时间:2020/12/10
Relativistic eigenchannel R-matrix studies of the strong intrashell electron correlations in highly charged Ar13+ ions 期刊论文
PHYSICAL REVIEW A, 2020, 卷号: 101, 期号: 3, 页码: 10
作者:  Dou, Li-Jun;  Jin, Rui;  Sun, Rui;  Xie, Lu-You;  Huang, Zhong-Kui
收藏  |  浏览/下载:25/0  |  提交时间:2022/01/18
Second Harmonic Generation Susceptibilities from Symmetry Adapted Wannier Functions 期刊论文
PHYSICAL REVIEW LETTERS, 2020, 卷号: 125, 期号: 18, 页码: 1-6
作者:  Lei, BH (Lei, Bing-Hua)[ 1,2,3 ];  Pan, SL (Pan, Shilie)[ 1,2,3 ];  Yang, ZH (Yang, Zhihua)[ 1,2,3 ];  Cao, C (Cao, Chao)[ 1,2,4 ];  Singh, DJ (Singh, David J.)[ 5,6 ]
收藏  |  浏览/下载:23/0  |  提交时间:2020/12/07
Enhanced Zintl anions by carbon doping in Al-Na clusters and new magic structure Al6Na4C 期刊论文
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 2019, 卷号: 119, 期号: 9
作者:  Tang, Jianling;  Zhang, Cairong;  Du, Ning;  Zhao, Yanyan;  Chen, Hongshan
收藏  |  浏览/下载:12/0  |  提交时间:2019/11/15


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