[1] |
Zhang Xiao-Ya, Song Jia-Xun, Wang Xin-Hao, Wang Jin-Bin, Zhong Xiang-Li.First principles calculation of optical absorption and polarization properties of In dopedh-LuFeO3. Acta Physica Sinica, 2021, 70(3): 037101.doi:10.7498/aps.70.20201287 |
[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] |
Jia Wan-Li, Zhou Miao, Wang Xin-Mei, Ji Wei-Li.First-principles study on the optical properties of Fe-doped GaN. Acta Physica Sinica, 2018, 67(10): 107102.doi:10.7498/aps.67.20172290 |
[4] |
Tao Peng-Cheng, Huang Yan, Zhou Xiao-Hao, Chen Xiao-Shuang, Lu Wei.First principles investigation of the tuning in metal-MoS2 interface induced by doping. Acta Physica Sinica, 2017, 66(11): 118201.doi:10.7498/aps.66.118201 |
[5] |
Zhu Yue, Li Yong-Cheng, Wang Fu-He.First principles study on the H2 diffusion and desorption at the Li-doped MgH2(001) surface. Acta Physica Sinica, 2016, 65(5): 056801.doi:10.7498/aps.65.056801 |
[6] |
Wang Hai-Yan, Hu Qian-Ku, Yang Wen-Peng, Li Xu-Sheng.Influence of metal element doping on the mechanical properties of TiAl alloy. Acta Physica Sinica, 2016, 65(7): 077101.doi:10.7498/aps.65.077101 |
[7] |
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.doi:10.7498/aps.64.087101 |
[8] |
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 |
[9] |
Fan Li-Hua, Cao Jue-Xian.The catalytic effect of transition matel doped Al (111) surfaces for hydrogen splitting. Acta Physica Sinica, 2015, 64(3): 038801.doi:10.7498/aps.64.038801 |
[10] |
Cao Juan, Cui Lei, Pan Jing.Magnetism of V, Cr and Mn doped MoS2 by first-principal study. Acta Physica Sinica, 2013, 62(18): 187102.doi:10.7498/aps.62.187102 |
[11] |
Li Hong-Lin, Zhang Zhong, Lü Ying-Bo, Huang Jin-Zhao, Zhang Ying, Liu Ru-Xi.First principles study on the electronic and optical properties of ZnO doped with rare earth. Acta Physica Sinica, 2013, 62(4): 047101.doi:10.7498/aps.62.047101 |
[12] |
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 |
[13] |
Liang Pei, Liu Yang, Wang Le, Wu Ke, Dong Qian-Min, Li Xiao-Yan.Investigation of the doping failure induced by DB in the SiNWs using first principles method. Acta Physica Sinica, 2012, 61(15): 153102.doi:10.7498/aps.61.153102 |
[14] |
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.doi:10.7498/aps.60.127302 |
[15] |
Le Ling-Cong, Ma Xin-Guo, Tang Hao, Wang Yang, Li Xiang, Jiang Jian-Jun.Electronic structure and optical properties of transition metal doped titanate nanotubes. Acta Physica Sinica, 2010, 59(2): 1314-1320.doi:10.7498/aps.59.1314 |
[16] |
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 |
[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] |
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.doi:10.7498/aps.56.6592 |
[19] |
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 |
[20] |
Lin Qiu-Bao, Li Ren-Quan, Zeng Yong-Zhi, Zhu Zi-Zhong.Electronic and magnetic properties of 3d transition-metal-doped Ⅲ-Ⅴ semiconductors:first-principle calculations. Acta Physica Sinica, 2006, 55(2): 873-878.doi:10.7498/aps.55.873 |