[1] |
Fu Xian-Kai, Chen Wan-Qi, Jiang Zhong-Sheng, Yang Bo, Zhao Xiang, Zuo Liang.First-principles investigation on elastic, electronic, and optical properties of Ti3O5. Acta Physica Sinica, 2019, 68(20): 207301.doi:10.7498/aps.68.20190664 |
[2] |
Jiang Wen-Can, Chen Hua, Zhang Wei-Bin.First-principles study of the phonon spectrum and heat capacity of TATB crystal. Acta Physica Sinica, 2016, 65(12): 126301.doi:10.7498/aps.65.126301 |
[3] |
Cheng He-Ping, Dan Jia-Kun, Huang Zhi-Meng, Peng Hui, Chen Guang-Hua.First-principles study on the electronic structure and optical properties of RDX. Acta Physica Sinica, 2013, 62(16): 163102.doi:10.7498/aps.62.163102 |
[4] |
Li Yu-Bo, Wang Xiao, Dai Ting-Ge, Yuan Guang-Zhong, Yang Hang-Sheng.First-principle study of vacancy-induced cubic boron nitride electronic structure and optical propertiy changes. Acta Physica Sinica, 2013, 62(7): 074201.doi:10.7498/aps.62.074201 |
[5] |
Chen Zhong-Jun.First principles study of the elastic, electronic and optical properties of MgS under pressure. Acta Physica Sinica, 2012, 61(17): 177104.doi:10.7498/aps.61.177104 |
[6] |
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 |
[7] |
Du Yu-Jie, Chang Ben-Kang, Zhang Jun-Ju, Li Biao, Wang Xiao-Hui.First-principles study of the electronic structure and optical properties of GaN(0001) surface. Acta Physica Sinica, 2012, 61(6): 067101.doi:10.7498/aps.61.067101 |
[8] |
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 |
[9] |
Sun Wei-Feng, Li Mei-Cheng, Zhao Lian-Cheng.Phonon band structure and electron-phonon interactions in Ga and Sb nanowires: a first-principles study. Acta Physica Sinica, 2010, 59(10): 7291-7297.doi:10.7498/aps.59.7291 |
[10] |
Kong Xiang-Lan, Hou Qin-Ying, Su Xi-Yu, Qi Yan-Hua, Zhi Xiao-Fen.First-principles study of the electronic structure and optical properties of Ba0.5Sr0.5TiO3. Acta Physica Sinica, 2009, 58(6): 4128-4131.doi:10.7498/aps.58.4128 |
[11] |
Guan Li, Li Qiang, Zhao Qing-Xun, Guo Jian-Xin, Zhou Yang, Jin Li-Tao, Geng Bo, Liu Bao-Ting.First-principles study of the optical properties of ZnO doped with Al, Ni. Acta Physica Sinica, 2009, 58(8): 5624-5631.doi:10.7498/aps.58.5624 |
[12] |
Lin Zhu, Guo Zhi-You, Bi Yan-Jun, Dong Yu-Cheng.Ferromagnetism and the optical properties of Cu-doped AlN from first-principles study. Acta Physica Sinica, 2009, 58(3): 1917-1923.doi:10.7498/aps.58.1917 |
[13] |
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.doi:10.7498/aps.58.1901 |
[14] |
Wang Hai-Yan, Cui Hong-Bao, Li Chang-Yun, Li Xu-Sheng, Wang Kuang-Fei.First-principles studies of the phase transition and thermodynamic properties of AlAs. Acta Physica Sinica, 2009, 58(8): 5598-5603.doi:10.7498/aps.58.5598 |
[15] |
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 |
[16] |
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 |
[17] |
.First principles investigation of structural stability and electronic and optical properties of LiF and NaF under high pressure. Acta Physica Sinica, 2007, 56(12): 7201-7206.doi:10.7498/aps.56.7201 |
[18] |
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 |
[19] |
Wang Yuan-Xu, Wang Chun-Lei, Zhong Wei-Lie, Zhao Ming-Lei, Li Ji-Chao, Xue Xu-Yan.Optical properties of SrTiO3 and SrHfO3 by first principle calculations. Acta Physica Sinica, 2004, 53(1): 214-217.doi:10.7498/aps.53.214 |
[20] |
WANG REN-ZHI, HUANG MEI-CHUN.STUDY OF OPTIC AL-PHONON DEFORMATION POTENTIALS IN Ga1-xAlxAs. Acta Physica Sinica, 1990, 39(11): 1778-1784.doi:10.7498/aps.39.1778 |