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2021, 70(17): 178503.
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Gong Ling-Yun, Zhang Ping, Chen qian, Lou Zhi-Hao, Xu Jie, Gao Feng. First principles study of structure and property of Nb5+-doped SrTiO3. Acta Physica Sinica,
2021, 70(22): 227101.
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Cai Meng-Yuan, Tang Chun-Mei, Zhang Qiu-Yue. Optimized Li storage performance of B, N doped graphyne as Li-ion battery anode materials. Acta Physica Sinica,
2019, 68(21): 213601.
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Qi Yu-Min, Chen Heng-Li, Jin Peng, Lu Hong-Yan, Cui Chun-Xiang. First-principles study of electronic structures and optical properties of Mn and Cu doped potassium hexatitanate (K2Ti6O13). Acta Physica Sinica,
2018, 67(6): 067101.
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Pan Feng-Chun, Xu Jia-Nan, Yang Hua, Lin Xue-Ling, Chen Huan-Ming. Ferromagnetism of undoped anatase TiO2 based on the first-principles calculations. Acta Physica Sinica,
2017, 66(5): 056101.
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Jia Ming-Zhen, Wang Hong-Yan, Chen Yuan-Zheng, Ma Cun-Liang, Wang Hui. First-principles study of electronic structures and electrochemical properties for Al, Fe and Mg doped Li2MnSiO4. Acta Physica Sinica,
2015, 64(8): 087101.
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Pan Feng-Chun, Lin Xue-Ling, Chen Huan-Ming. Electronic structure and optical properties of C doped rutile TiO2: the first-principles calculations. Acta Physica Sinica,
2015, 64(22): 224218.
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Shen Jie, Wei Bin, Zhou Jing, Shen Shirley Zhiqi, Xue Guang-Jie, Liu Han-Xing, Chen Wen. First-principle study of electronic structure and optical properties of Ba(Mg1/3Nb2/3)O3. Acta Physica Sinica,
2015, 64(21): 217801.
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Linghu Jia-Jun, Liang Gong-Ying. First-principles study on the luminescence property of In-doped ZnTe. Acta Physica Sinica,
2013, 62(10): 103102.
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Zheng Shu-Kai, Wu Guo-Hao, Liu Lei. First-principles calculations of P-doped anatase TiO2. Acta Physica Sinica,
2013, 62(4): 043102.
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Li Zong-Bao, Wang Xia, Jia Li-Chao. Synergistic effects in Fe/N codoped anatase TiO2 (101) surface:a theoretical study based on density functional theory calculation. Acta Physica Sinica,
2013, 62(20): 203103.
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Wang Yin, Feng Qing, Wang Wei-Hua, Yue Yuan-Xia. First-principles study on the electronic and optical property of C-Zn co-doped anatase TiO2. Acta Physica Sinica,
2012, 61(19): 193102.
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Zhang Rui-Shuo, Liu Yong, Teng Fan, Song Chen-Lu, Han Gao-Rong. Electronic and optical properties of anatase and rutile TiO2:Nb. Acta Physica Sinica,
2012, 61(1): 017101.
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Guan Dong-Bo, Mao Jian. First principles study of the electronic structure and optical properties of Magnli phase titanium suboxides Ti8O15. Acta Physica Sinica,
2012, 61(1): 017102.
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Lin Qi, Chen Yu-Hang, Wu Jian-Bao, Kong Zong-Min. Effect of N-doping on band structure and transport property of zigzag graphene nanoribbons. Acta Physica Sinica,
2011, 60(9): 097103.
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Wu Xue-Wei, Wu Da-Jian, Liu Xiao-Jun. Effects of B(N, F) doping on optical properties of TiO2 nanoparticles. Acta Physica Sinica,
2010, 59(7): 4788-4793.
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Hou Qing-Yu, Zhao Chun-Wang, Jin Yong-Jun. First-principles study on the effects of the concentration of Al-2N high codoping on the electric conducting performance of ZnO. Acta Physica Sinica,
2009, 58(10): 7136-7140.
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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.
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Zhao Zong-Yan, Liu Qing-Ju, Zhang Jin, Zhu Zhong-Qi. First-principles study of 3d transition metal-doped anatase. Acta Physica Sinica,
2007, 56(11): 6592-6599.
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2007, 56(2): 1048-1053.
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