[1] |
Xu Xian-Da, Zhao Lei, Sun Wei-Feng.First-principles on the energy band mechanism for modifying conduction property of graphene nanomeshes. Acta Physica Sinica, 2020, 69(4): 047101.doi:10.7498/aps.69.20190657 |
[2] |
Li Lin, Sun Yu-Xuan, Sun Wei-Feng.First-principles study of electronic structure, magnetic and optical properties of laminated molybdenum oxides. Acta Physica Sinica, 2019, 68(5): 057101.doi:10.7498/aps.68.20181962 |
[3] |
Fang Yu-Zhen, Kong Xiang-Jin, Wang Dong-Ting, Cui Shou-Xin, Liu Jun-Hai.First principle study of electron and band structure of BixBa1-xTiO3. Acta Physica Sinica, 2018, 67(11): 117101.doi:10.7498/aps.67.20172644 |
[4] |
Liu Hui-Ying, Zhang Xiu-Qin, Fang Yi-Mei, Zhu Zi-Zhong.Structural and electronic properties of T-graphene and its derivatives. Acta Physica Sinica, 2017, 66(16): 166101.doi:10.7498/aps.66.166101 |
[5] |
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 |
[6] |
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.doi:10.7498/aps.64.124210 |
[7] |
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.doi:10.7498/aps.64.217801 |
[8] |
Luo Zui-Fen, Cen Wei-Fu, Fan Meng-Hui, Tang Jia-Jun, Zhao Yu-Jun.First-principles study of electronic and optical properties of BiTiO3. Acta Physica Sinica, 2015, 64(14): 147102.doi:10.7498/aps.64.147102 |
[9] |
Gao Tan-Hua.Structural and electronic properties of hydrogenated bilayer silicene. Acta Physica Sinica, 2015, 64(7): 076801.doi:10.7498/aps.64.076801 |
[10] |
Gao Tan-Hua, Wu Shun-Qing, Zhang Peng, Zhu Zi-Zhong.Structural and electronic properties of hydrogenated bilayer boron nitride. Acta Physica Sinica, 2014, 63(1): 016801.doi:10.7498/aps.63.016801 |
[11] |
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 |
[12] |
Yang Chun-Yan, Zhang Rong, Zhang Li-Min, Ke Xiang-Wei.Electronic structure and optical properties of 0.5NdAlO3-0.5CaTiO3 from first-principles calculation. Acta Physica Sinica, 2012, 61(7): 077702.doi:10.7498/aps.61.077702 |
[13] |
Li Rong, Luo Xiao-Ling, Liang Guo-Ming, Fu Wen-Sheng.Influence of doped rare earth elements on the dehydrogenation properties of VH2. Acta Physica Sinica, 2012, 61(9): 093601.doi:10.7498/aps.61.093601 |
[14] |
Gao Tan-Hua, Liu Hui-Ying, Zhang Peng, Wu Shun-Qing, Yang Yong, Zhu Zi-Zhong.Structural and electronic properties of Al-doped spinel LiMn2O4. Acta Physica Sinica, 2012, 61(18): 187306.doi:10.7498/aps.61.187306 |
[15] |
Zhu Ying-Tao, Yang Chuan-Lu, Wang Mei-Shan, Dong Yong-Mian.First-principles calculations on the electrical structures and vibration frequencies of β-Si3N4. Acta Physica Sinica, 2008, 57(2): 1048-1053.doi:10.7498/aps.57.1048 |
[16] |
Ni Jian-Gang, Liu Nuo, Yang Guo-Lai, Zhang Xi.First-principle study on electronic structure of BaTiO3 (001) surfaces. Acta Physica Sinica, 2008, 57(7): 4434-4440.doi:10.7498/aps.57.4434 |
[17] |
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 |
[18] |
Wang Song-You, Duan Guo-Yu, Qiu Jian-Hong, Jia Yu, Chen Liang-Yao.PtN in zinc-blende structure: An unstable metallic transition-metal nitride compound. Acta Physica Sinica, 2006, 55(4): 1979-1982.doi:10.7498/aps.55.1979 |
[19] |
Zhang Yong, Tang Chao-Qun, Dai Jun.Ab inition studies on the electric and optical properties of Rb2TeW3O12. Acta Physica Sinica, 2005, 54(2): 868-874.doi:10.7498/aps.54.868 |
[20] |
Liu Hui-Ying, Hou Zhu-Feng, Zhu Zi-Zhong, Huang Mei-Chun, Yang Yong.First-principles calculation on the formation energies oflithium insertion in In Sb. Acta Physica Sinica, 2003, 52(7): 1732-1736.doi:10.7498/aps.52.1732 |