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Zhang Ying-Nan, Zhang Min, Zhang Pai, Hu Wen-Bo. Investigation of electronic structure and optoelectronic properties of Si-doped β-Ga2O3 using GGA+U method based on first-principle. Acta Physica Sinica,
2024, 73(1): 017102.
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Liu Qi, Guan Peng-Fei. First principle study on atomic structure of La65X35(X=Ni, Al) metallic glasses. Acta Physica Sinica,
2018, 67(17): 178101.
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Cheng Chao, Wang Xun, Sun Jia-Xing, Cao Chao-Ming, Ma Yun-Li, Liu Yan-Xia. Electronic structure calculation of Cr content effect on corrosion resistance of Ti-Nb-Cr alloy. Acta Physica Sinica,
2018, 67(19): 197101.
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Hu Jie-Qiong, Xie Ming, Chen Jia-Lin, Liu Man-Men, Chen Yong-Tai, Wang Song, Wang Sai-Bei, Li Ai-Kun. First principles study of electronic and elastic properties of Ti3AC2 (A = Si, Sn, Al, Ge) phases. Acta Physica Sinica,
2017, 66(5): 057102.
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Niu Xue-Lian, Wang Li-Jiu, Sun Dan. The DFT analyses of effect of chromium and nickel additions on the mechanical properties of Fe3Al based alloys. Acta Physica Sinica,
2013, 62(3): 037104.
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Zhang Guo-Lian, Lu Yao, Jiang Lei, Wang Zhe, Zhang Chang-Wen, Wang Pei-Ji. First-principle study on optoelectronic and magnetic properties of Sn(O1-xNx)2. Acta Physica Sinica,
2012, 61(11): 117101.
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Sun Wei-Feng. First-principles study of (InAs)1/(GaSb)1 superlattice atomic chains. Acta Physica Sinica,
2012, 61(11): 117104.
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Sun Wei-Feng, Zheng Xiao-Xia. First-principles study of (InAs)1/(GaSb)1 superlattice nanowires. Acta Physica Sinica,
2012, 61(11): 117103.
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Sun Wei-Feng, Zheng Xiao-Xia. First-principles study of interface relaxation effects on interface structure, band structure and optical property of InAs/GaSb superlattices. Acta Physica Sinica,
2012, 61(11): 117301.
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Zhang Zhen-Duo, Hou Qing-Yu, Li Cong, Zhao Chun-Wang. First-principles study of the electronic structure and absorption spectrum of heavily Nd-doped anatase TiO2. Acta Physica Sinica,
2012, 61(11): 117102.
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Deng Yong-He, Liu Jing-Shuo. Formation abilities and electronic properties of Mg-TM-H (TM = Sc, Ti, V, Y, Zr, Nb) crystal. Acta Physica Sinica,
2011, 60(11): 117102.
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Wang Ying-Long, Wang Xiu-Li, Liang Wei-Hua, Guo Jian-Xin, Ding Xue-Cheng, Chu Li-Zhi, Deng Ze-Chao, Fu Guang-Sheng. First principles study of electronic and optical properties of Er-doped silicon nanoparticles with different densities. Acta Physica Sinica,
2011, 60(12): 127302.
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Yu Ben-Hai, Liu Mo-Lin, Chen Dong. First principles study of structural, electronic and elastic properties of Mg2 Si polymorphs. Acta Physica Sinica,
2011, 60(8): 087105.
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Ji Zheng-Hua, Zeng Xiang-Hua, Cen Jie-Ping, Tan Ming-Qiu. Electronic structure and phase transformation in ZnSe: An ab initio study. Acta Physica Sinica,
2010, 59(2): 1219-1224.
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Ouyang Fang-Ping, Xu Hui, Wei Chen. First-principles study of electronic structure and transport properties of zigzag graphene nanoribbons. Acta Physica Sinica,
2008, 57(2): 1073-1077.
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Zhu Ying-Tao, Yang Chuan-Lu, Wang Mei-Shan, Dong Yong-Mian. First-principles calculations on the electrical structures and vibration frequencies of β-Si3N4. Acta Physica Sinica,
2008, 57(2): 1048-1053.
doi: 10.7498/aps.57.1048
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Qiu An-Ning, Zhang Lan-Ting, Wu Jian-Sheng. First principles study of the electronic structure of ReSi1.75. Acta Physica Sinica,
2007, 56(8): 4891-4895.
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Pan Hong-Zhe, Xu Ming, Zhu Wen-Jun, Zhou Hai-Ping. First-principles study on the electrical structures and optical properties of β-Si3N4. Acta Physica Sinica,
2006, 55(7): 3585-3589.
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Xu Xiao-Guang, Wang Chun-Zhong, Liu Wei, Meng Xing, Sun Yuan, Chen Gang. Ab initio study of the effects of Mg doping on electronic structure of Li(Co , Al)O2. Acta Physica Sinica,
2005, 54(1): 313-316.
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Xu Xiao-Guang, Wei Ying-Jin, Meng Xing, Wang Chun-Zhong, Huang Zu-Fei, Chen Gang. Ab initio study of the effects of Mg, Al dopingon the electronic structure of LiCoO2. Acta Physica Sinica,
2004, 53(1): 210-213.
doi: 10.7498/aps.53.210
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