[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] |
Lü Chang-Wei, Wang Chen-Ju, Gu Jian-Bing.First-principles study of structural, elastic, thermodynamic, electronic and optical properties of cubic boron nitride and hexagonal boron nitride at high temperature and high pressure. Acta Physica Sinica, 2019, 68(7): 077102.doi:10.7498/aps.68.20182030 |
[3] |
Hu Jie-Qiong, Xie Ming, Chen Jia-Lin, Liu Man-Men, Chen Yong-Tai, Wang Song, Wang Sai-Bei, Li Ai-Kun.First principles study of electronic and elastic properties of Ti3AC2 (A = Si, Sn, Al, Ge) phases. Acta Physica Sinica, 2017, 66(5): 057102.doi:10.7498/aps.66.057102 |
[4] |
Deng Shi-Jie, Zhao Yu-Hong, Hou Hua, Wen Zhi-Qin, Han Pei-De.Structural, mechanical and thermodynamic properties of Ti2AlX (X= C, N) at high pressure. Acta Physica Sinica, 2017, 66(14): 146101.doi:10.7498/aps.66.146101 |
[5] |
Wu Ruo-Xi, Liu Dai-Jun, Yu Yang, Yang Tao.First-principles investigations on structure and thermodynamic properties of CaS under high pressures. Acta Physica Sinica, 2016, 65(2): 027101.doi:10.7498/aps.65.027101 |
[6] |
Liu Bo, Wang Xuan-Jun, Bu Xiao-Yu.First principles investigations of structural, electronic and elastic properties of ammonium perchlorate under high pressures. Acta Physica Sinica, 2016, 65(12): 126102.doi:10.7498/aps.65.126102 |
[7] |
Zhai Dong, Wei Zhao, Feng Zhi-Fang, Shao Xiao-Hong, Zhang Ping.Properties of Cu1-xWx alloys at high pressure and high temperature from first-principles calculations. Acta Physica Sinica, 2014, 63(20): 206501.doi:10.7498/aps.63.206501 |
[8] |
Wang Jin-Rong, Zhu Jun, Hao Yan-Jun, Ji Guang-Fu, Xiang Gang, Zou Yang-Chun.First-principles study of the structural, elastic and electronic properties of RhB under high pressure. Acta Physica Sinica, 2014, 63(18): 186401.doi:10.7498/aps.63.186401 |
[9] |
Zhao Li-Kai, Zhao Er-Jun, Wu Zhi-Jian.First-principles calculations of structural thermodynamic and mechanical properties of 5d transitional metal diborides. Acta Physica Sinica, 2013, 62(4): 046201.doi:10.7498/aps.62.046201 |
[10] |
Zhou Ping, Wang Xin-Qiang, Zhou Mu, Xia Chuan-Hui, Shi Ling-Na, Hu Cheng-Hua.First-principles study of pressure induced phase transition, electronic structure and elastic properties of CdS. Acta Physica Sinica, 2013, 62(8): 087104.doi:10.7498/aps.62.087104 |
[11] |
Yang Ze-Jin, Linghu Rong-Feng, Cheng Xin-Lu, Yang Xiang-Dong.First-principles investigations on the electronic, elastic and thermodynamic properties of Cr2MC(M=Al, Ga). Acta Physica Sinica, 2012, 61(4): 046301.doi:10.7498/aps.61.046301 |
[12] |
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 |
[13] |
Wang Bin, Liu Ying, Ye Jin-Wen.First-principle calculations of elastic, electronic and thermodynamic properties of TiC under high pressure. Acta Physica Sinica, 2012, 61(18): 186501.doi:10.7498/aps.61.186501 |
[14] |
Yang Li-Jun, Chen Hai-Chuan.First-principles calculations of electronic structure, optical and elastic properties of LiGaX2(X=S, Se, Te). Acta Physica Sinica, 2011, 60(1): 014207.doi:10.7498/aps.60.014207 |
[15] |
Ru Qiang, Hu She-Jun, Zhao Ling-Zhi.First-principles study of the electronic structure and elastic property of Li x FePO4. Acta Physica Sinica, 2011, 60(3): 036301.doi:10.7498/aps.60.036301 |
[16] |
Li Xiao-Feng, Liu Zhong-Li, Peng Wei-Min, Zhao A-Ke.Elastic and thermodynamic properties of CaPo under pressure via first-principles calculations. Acta Physica Sinica, 2011, 60(7): 076501.doi:10.7498/aps.60.076501 |
[17] |
Hou Yu-Qing, Zhang Xiao-Dong, Jiang Zhen-Yi.First-principles calculation of structure, electronic and elastic properties of MAlH4(M=Na, K). Acta Physica Sinica, 2010, 59(8): 5667-5671.doi:10.7498/aps.59.5667 |
[18] |
Chen Yi, Shen Jiang.Structural and thermodynamic properties of Fe based compounds with NaZn13-type. Acta Physica Sinica, 2009, 58(13): 141-S145.doi:10.7498/aps.58.141 |
[19] |
Liu Na-Na, Song Ren-Bo, Sun Han-Ying, Du Da-Wei.The electronic structure and thermodynamic properties of Mg2Sn from first-principles calculations. Acta Physica Sinica, 2008, 57(11): 7145-7150.doi:10.7498/aps.57.7145 |
[20] |
Ding Ying-Chun, Xu Ming, Pan Hong-Zhe, Shen Yi-Bin, Zhu Wen-Jun, He Hong-Liang.Electronic structure and physical properties of γ-Si3N4 under high pressure. Acta Physica Sinica, 2007, 56(1): 117-122.doi:10.7498/aps.56.117 |