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Wu Hong-Fen, Feng Pan-Jun, Zhang Shuo, Liu Da-Peng, Gao Miao, Yan Xun-Wang. First-principles study of Fe atom adsorbed biphenylene monolayer. Acta Physica Sinica,
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Zhang Yun, Wang Xue-Wei, Bai Hong-Mei. First-principles study on the electronic structures and the absorption spectra of In: Mn: LiNbO3 crystals. Acta Physica Sinica,
2017, 66(2): 024208.
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Xu Zhen-Chao, Hou Qing-Yu. GGA+U study on the effects of Ag doping on the electronic structures and absorption spectra of ZnO. Acta Physica Sinica,
2015, 64(15): 157101.
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Zhao Bai-Qiang, Zhang Yun, Qiu Xiao-Yan, Wang Xue-Wei. First-principles study of the electronic structures and absorption spectrum of Fe:Mg:LiNbO3 crystals. Acta Physica Sinica,
2015, 64(12): 124210.
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Hou Qing-Yu, Guo Shao-Qiang, Zhao Chun-Wang. First-principle study of the effects of oxygen vacancy on the electronic structure and the absorption spectrum of ZnO. Acta Physica Sinica,
2014, 63(14): 147101.
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Wang Ping, Guo Li-Xin, Yang Yin-Tang, Zhang Zhi-Yong. First-principles study on electronic structures of Al, N Co-doped ZnO nanotubes. Acta Physica Sinica,
2013, 62(5): 056105.
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Qian Shuai, Guo Xin-Li, Wang Jia-Jia, Yu Xin-Quan, Wu San-Xie, Yu Jin. First principles study of structures, static polarizabilities and optical absorption spectra of Cun-1Au (n=2–10) clusters. Acta Physica Sinica,
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Hou Qing-Yu, Dong Hong-Ying, Ying Chun, Ma Wen. First-principles study on the effect of high Mn doped on the band gap and absorption spectrum of ZnO. Acta Physica Sinica,
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Deng Jiao-Jiao, Liu Bo, Gu Mu, Liu Xiao-Lin, Huang Shi-Ming, Ni Chen. First principles calculation of electronic structures and optical properties for -CuX(X = Cl, Br, I). Acta Physica Sinica,
2012, 61(3): 036105.
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Hou Qing-Yu, Dong Hong-Ying, Ying Chun, Ma Wen. First-principles study on the effects of high Al doped on the band gap and absorption spectrum of ZnO. Acta Physica Sinica,
2012, 61(16): 167102.
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Li Cong, Hou Qing-Yu, Zhang Zhen-Duo, Zhao Chun-Wang, Zhang Bing. First-principles study on the electronic structures and absorption spectra of Sm-N codoped anatase TiO2. Acta Physica Sinica,
2012, 61(16): 167103.
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Li Pei-Juan, Zhou Wei-Wei, Tang Yuan-Hao, Zhang Hua, Shi Si-Qi. Electronic structure，optical and lattice dynamical properties of CeO2：A first-principles study. Acta Physica Sinica,
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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.
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Wu Hong-Li, Zhao Xin-Qing, Gong Sheng-Kai. Effect of Nb on electronic structure of NiTi intermetallic compound: A first-principles study. Acta Physica Sinica,
2010, 59(1): 515-520.
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Hu Fang, Ming Xing, Fan Hou-Gang, Chen Gang, Wang Chun-Zhong, Wei Ying-Jin, Huang Zu-Fei. First-principles study on the electronic structures of the ladder compound NaV2O4F. Acta Physica Sinica,
2009, 58(2): 1173-1178.
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Song Qing-Gong, Wang Yan-Feng, Song Qing-Long, Kang Jian-Hai, Chu Yong. First-principle study on the electronic structures of intercalation compound Ag1/4TiSe2. Acta Physica Sinica,
2008, 57(12): 7827-7832.
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Wu Hong-Li, Zhao Xin-Qing, Gong Sheng-Kai. Effect of Nb doping on electronic structure of TiO2/NiTi interface: A first-principle study. Acta Physica Sinica,
2008, 57(12): 7794-7799.
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Wang Ce, Chen Xiao-Bo, Zhang Chun-Lin, Zhang Yun-Zhi, Chen Luan, Ma Hui, Li Song, Gao Ai-Hua. Optical parameters and energy level splitting of Er3+ in Er3+: GdVO4. Acta Physica Sinica,
2007, 56(10): 6090-6097.
doi: 10.7498/aps.56.6090
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