[1] |
Lin Hong-Bin, Lin Chun, Chen Yue, Zhong Ke-Hua, Zhang Jian-Min, Xu Gui-Gui, Huang Zhi-Gao.First-principles study of effect of Mg doping on structural stability and electronic structure of LiCoO2cathode material. Acta Physica Sinica, 2021, 70(13): 138201.doi:10.7498/aps.70.20210064 |
[2] |
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.doi:10.7498/aps.67.20172356 |
[3] |
Ding Chao, Li Wei1\2\3, Liu Ju-Yan, Wang Lin-Lin, Cai Yun, Pan Pei-Feng.First principle study of electronic structure of Sb, S Co-doped SnO2. Acta Physica Sinica, 2018, 67(21): 213102.doi:10.7498/aps.67.20181228 |
[4] |
Zhao Bai-Qiang, Zhang Yun, Qiu Xiao-Yan, Wang Xue-Wei.First-principles study on the electronic structures and optical properties of Cu, Fe doped LiNbO_3 crystals. Acta Physica Sinica, 2016, 65(1): 014212.doi:10.7498/aps.65.014212 |
[5] |
Xu Jing, Liang Jia-Qing, Li Hong-Ping, Li Chang-Sheng, Liu Xiao-Juan, Meng Jian.First-principles study on the electronic structure of Ti-doped NbSe2. Acta Physica Sinica, 2015, 64(20): 207101.doi:10.7498/aps.64.207101 |
[6] |
Chen Li-Jing, Li Wei-Xue, Dai Jian-Feng, Wang Qing.First-prinicples study of Mn-N co-doped p-type ZnO. Acta Physica Sinica, 2014, 63(19): 196101.doi:10.7498/aps.63.196101 |
[7] |
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 |
[8] |
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.doi:10.7498/aps.61.167103 |
[9] |
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.doi:10.7498/aps.61.017102 |
[10] |
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.doi:10.7498/aps.61.193102 |
[11] |
Deng Bei, Sun Hui-Qing, Guo Zhi-You, Gao Xiao-Qi.Theoretical analysis on the improvement of p-type ZnO by B-N codoping. Acta Physica Sinica, 2010, 59(2): 1212-1218.doi:10.7498/aps.59.1212 |
[12] |
Hu Zhi-Gang, Duan Man-Yi, Xu Ming, Zhou Xun, Chen Qing-Yun, Dong Cheng-Jun, Linghu Rong-Feng.Electronic structure and optical properties of ZnO doped with Fe and Ni. Acta Physica Sinica, 2009, 58(2): 1166-1172.doi:10.7498/aps.58.1166 |
[13] |
Dang Sui-Hu, Li Chun-Xia, Han Pei-De.First-principles calculation of CdS electronic structure doped with Mg and Cu. Acta Physica Sinica, 2009, 58(6): 4137-4143.doi:10.7498/aps.58.4137 |
[14] |
Bi Yan-Jun, Guo Zhi-You, Sun Hui-Qing, Lin Zhu, Dong Yu-Cheng.The electronic structure and optical properties of Co and Mn codoped ZnO from first-principle study. Acta Physica Sinica, 2008, 57(12): 7800-7805.doi:10.7498/aps.57.7800 |
[15] |
Zhao Hui-Fang, Cao Quan-Xi, Li Jian-Tao.First-principle study of N,Ga codoped p-type ZnO. Acta Physica Sinica, 2008, 57(9): 5828-5832.doi:10.7498/aps.57.5828 |
[16] |
Yang Yin-Tang, Wu Jun, Cai Yu-Rong, Ding Rui-Xue, Song Jiu-Xu, Shi Li-Chun.First principles investigation on conductivity mechanism of p-type K:ZnO. Acta Physica Sinica, 2008, 57(11): 7151-7156.doi:10.7498/aps.57.7151 |
[17] |
Duan Man-Yi, Xu Ming, Zhou Hai-Ping, Shen Yi-Bin, Chen Qing-Yun, Ding Ying-Chun, Zhu Wen-Jun.First-principles study on the electronic structure and optical properties of ZnO doped with transition metal and N. Acta Physica Sinica, 2007, 56(9): 5359-5365.doi:10.7498/aps.56.5359 |
[18] |
Shen Yi-Bin, Zhou Xun, Xu Ming, Ding Ying-Chun, Duan Man-Yi, Linghu Rong-Feng, Zhu Wen-Jun.Electronic structure and optical properties of ZnO doped with transition metals. Acta Physica Sinica, 2007, 56(6): 3440-3445.doi:10.7498/aps.56.3440 |
[19] |
Ding Shao-Feng, Fan Guang-Han, Li Shu-Ti, Xiao Bing.First-principles study of the p-type doped InN. Acta Physica Sinica, 2007, 56(7): 4062-4067.doi:10.7498/aps.56.4062 |
[20] |
Pan Zhi-Jun, Zhang Lan-Ting, Wu Jian-Sheng.A first-principle study of electronic and geometrical structures of semiconducting β-FeSi2 with doping. Acta Physica Sinica, 2005, 54(11): 5308-5313.doi:10.7498/aps.54.5308 |