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Wang Bu-Sheng, Liu Yong. Electronic structure and magnetic properties of MnTe from first-principles calculations. Acta Physica Sinica,
2016, 65(6): 066101.
doi: 10.7498/aps.65.066101
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Fan Hang, Wang Shan-Shan, Li Yu-Hong. Study on the electronic structure and elastic constants of uranium dioxide by first principles. Acta Physica Sinica,
2015, 64(9): 097101.
doi: 10.7498/aps.64.097101
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Cheng He-Ping, Dan Jia-Kun, Huang Zhi-Meng, Peng Hui, Chen Guang-Hua. First-principles study on the electronic structure and optical properties of RDX. Acta Physica Sinica,
2013, 62(16): 163102.
doi: 10.7498/aps.62.163102
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Huang You-Lin, Hou Yu-Hua, Zhao Yu-Jun, Liu Zhong-Wu, Zeng De-Chang, Ma Sheng-Can. Influences of strain on electronic structure and magnetic properties of CoFe2O4 from first-principles study. Acta Physica Sinica,
2013, 62(16): 167502.
doi: 10.7498/aps.62.167502
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Wu Mu-Sheng, Xu Bo, Liu Gang, Ouyang Chu-Ying. First-principles study on the electronic structures of Cr- and W-doped single-layer MoS2. Acta Physica Sinica,
2013, 62(3): 037103.
doi: 10.7498/aps.62.037103
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Chen Zhong-Jun. First principles study of the elastic, electronic and optical properties of MgS under pressure. Acta Physica Sinica,
2012, 61(17): 177104.
doi: 10.7498/aps.61.177104
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Song Qing-Gong, Liu Li-Wei, Zhao Hui, Yan Hui-Yu, Du Quan-Guo. First-principles study on the electronic structure and optical properties of YFeO3. Acta Physica Sinica,
2012, 61(10): 107102.
doi: 10.7498/aps.61.107102
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Du Yu-Jie, Chang Ben-Kang, Zhang Jun-Ju, Li Biao, Wang Xiao-Hui. First-principles study of the electronic structure and optical properties of GaN(0001) surface. Acta Physica Sinica,
2012, 61(6): 067101.
doi: 10.7498/aps.61.067101
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Wu Hai-Ping, Chen Dong-Guo, Huang De-Cai, Deng Kai-Ming. Electronic and magnetic properties of SrCoO3:the first principles study. Acta Physica Sinica,
2012, 61(3): 037101.
doi: 10.7498/aps.61.037101
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Li Kai, Tang Yong-Jian, Luo Jiang-Shan, Yi Yong, Ding Zhi-Jie. First-principles calculations of electronic structure and magnetism of Ni4NdB. Acta Physica Sinica,
2011, 60(9): 097503.
doi: 10.7498/aps.60.097503
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Wang Zhi-Gang, Zhang Yang, Wen Yu-Hua, Zhu Zi-Zhong. First-principles calculation of structural stability and electronic properties of ZnO atomic chains. Acta Physica Sinica,
2010, 59(3): 2051-2056.
doi: 10.7498/aps.59.2051
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Liang Wei-Hua, Ding Xue-Cheng, Chu Li-Zhi, Deng Ze-Chao, Guo Jian-Xin, Wu Zhuan-Hua, Wang Ying-Long. First-principles study of electronic and optical properties of Ni-doped silicon nanowires. Acta Physica Sinica,
2010, 59(11): 8071-8077.
doi: 10.7498/aps.59.8071
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Liu Xiao-Cun, Ji Yan-Ju, Zhao Jun-Qing, Liu Li-Qiang, Sun Zhao-Peng, Dong He-Lei. First-principles study on electronic structure of In-doped wurtzite ZnO. Acta Physica Sinica,
2010, 59(7): 4925-4929.
doi: 10.7498/aps.59.4925
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Zhang Ji-Hua, Ding Jian-Wen, Lu Zhang-Hui. First-principles study of electrical structures and optical properties of Co:MgF2 crystal. Acta Physica Sinica,
2009, 58(3): 1901-1907.
doi: 10.7498/aps.58.1901
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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.
doi: 10.7498/aps.57.1073
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Gao Wei, Zhu Jia-Qi, Niu Li, Han Jie-Cai, Dai Bao-Chang. Ab initio structural simulation and electronic structure of amorphous carbon. Acta Physica Sinica,
2008, 57(1): 398-404.
doi: 10.7498/aps.57.398
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Zhang Jin-Kui, Deng Sheng-Hua, Jin Hui, Liu Yue-Lin. First-principle study on the electronic structure and p-type conductivity of ZnO. Acta Physica Sinica,
2007, 56(9): 5371-5375.
doi: 10.7498/aps.56.5371
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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.
doi: 10.7498/aps.55.3585
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Zhang Jia-Hong, Liu Su, Gu Fang, Yang Li-Juan, Liu Mei. First-principles calculations of electronic structure and magnetism of Gd2Co2Al. Acta Physica Sinica,
2006, 55(6): 2928-2935.
doi: 10.7498/aps.55.2928
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Pan Zhi-Jun, Zhang Lan-Ting, Wu Jian-Sheng. First-principles study of electronic structure for CoSi. Acta Physica Sinica,
2005, 54(1): 328-332.
doi: 10.7498/aps.54.328
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