[1] |
Yuan Wen-Ling, Yao Bi-Xia, Li Xi, Hu Shun-Bo, Ren Wei.First principles study on structural stability, mechanical, and thermodynamic properties ofγ'-Co3(V,M) (M= Ti, Ta) phase. Acta Physica Sinica, 2024, 73(8): 086104.doi:10.7498/aps.73.20231755 |
[2] |
Zhu Cheng, Chen Xian-Hui, Wang Cheng, Song Ming, Xia Wei-Dong.Calculation of thermodynamic properties and transport coefficients of Ar-C-Si plasma. Acta Physica Sinica, 2023, 72(12): 125202.doi:10.7498/aps.72.20222390 |
[3] |
Hu Min-Li, Fang Fan, Fan Qun-Chao, Fan Zhi-Xiang, Li Hui-Dong, Fu Jia, Xie Feng.Theoretical study on macroscopic thermodynamic properties of NO+ion system. Acta Physica Sinica, 2023, 72(16): 165101.doi:10.7498/aps.72.20230541 |
[4] |
Jian Jun, Lei Jiao, Fan Qun-Chao, Fan Zhi-Xiang, Ma Jie, Fu Jia, Li Hui-Dong, Xu Yong-Gen.Theoretical study on thermodynamic properties of NO gas. Acta Physica Sinica, 2020, 69(5): 053301.doi:10.7498/aps.69.20191723 |
[5] |
Zhao Yu-Na, Cong Hong-Lu, Cheng Shuang, Yu Na, Gao Tao, Ma Jun-Gang.First-principles study of lattice dynamical and thermodynamic properties of Li2NH. Acta Physica Sinica, 2019, 68(13): 137102.doi:10.7498/aps.68.20190139 |
[6] |
Huang Ao, Lu Zhi-Peng, Zhou Meng, Zhou Xiao-Yun, Tao Ying-Qi, Sun Peng, Zhang Jun-Tao, Zhang Ting-Bo.Effects of the doping of Al and O interstitial atoms on thermodynamic properties of -Al2O3:first-principles calculations. Acta Physica Sinica, 2017, 66(1): 016103.doi:10.7498/aps.66.016103 |
[7] |
Lu Tao, Wang Jin, Fu Xu, Xu Biao, Ye Fei-Hong, Mao Jin-Bin, Lu Yun-Qing, Xu Ji.Theoretical calculation of the birefringence of poly-methyl methacrylate by using the density functional theory and molecular dynamics method. Acta Physica Sinica, 2016, 65(21): 210301.doi:10.7498/aps.65.210301 |
[8] |
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 |
[9] |
Yan Xiao-Zhen, Kuang Xiao-Yu, Mao Ai-Jie, Kuang Fang-Guang, Wang Zhen-Hua, Sheng Xiao-Wei.First-principles study on the elastic, electronic and thermodynamic properties of ErNi2B2C under high pressure. Acta Physica Sinica, 2013, 62(10): 107402.doi:10.7498/aps.62.107402 |
[10] |
Zhao Yu-Na, Gao Tao, Lü Jin-Zhong, Ma Jun-Gang.Thermodynamic properties of Li-N-H hydrogen storage: first-principles study. Acta Physica Sinica, 2013, 62(14): 143101.doi:10.7498/aps.62.143101 |
[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] |
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 |
[13] |
Zhang Wei, Chen Wen-Zhou, Wang Jun-Fei, Zhang Xiao-Dong, Jiang Zhen-Yi.Ab initio calculation of phase transitions, elastic, and thermodynamic properties of MnPd alloys. Acta Physica Sinica, 2012, 61(24): 246201.doi:10.7498/aps.61.246201 |
[14] |
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 |
[15] |
Xin Xiao-Gui, Chen Xiang, Zhou Jing-Jing, Shi Si-Qi.A first principles study of the lattice dynamics property of LiFePO4. Acta Physica Sinica, 2011, 60(2): 028201.doi:10.7498/aps.60.028201 |
[16] |
Li Shi-Na, Liu Yong.First-principles calculation of elastic and thermodynamic properties of copper nitride. Acta Physica Sinica, 2010, 59(10): 6882-6888.doi:10.7498/aps.59.6882 |
[17] |
Li Pei-Juan, Zhou Wei-Wei, Tang Yuan-Hao, Zhang Hua, Shi Si-Qi.Electronic structure,optical and lattice dynamical properties of CeO2:A first-principles study. Acta Physica Sinica, 2010, 59(5): 3426-3431.doi:10.7498/aps.59.3426 |
[18] |
Xu Bu-Yi, Chen Jun-Rong, Cai Jing, Li Quan, Zhao Ke-Qing.Theoretical study on the structure,spectra and thermodynamic property of 2-(toluene-4-sulfonylamino)-benzoic. Acta Physica Sinica, 2009, 58(3): 1531-1536.doi:10.7498/aps.58.1531 |
[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] |
Song Hai-Feng, Liu Hai-Feng.Theoretical study of thermodynamic properties of metal Be. Acta Physica Sinica, 2007, 56(5): 2833-2837.doi:10.7498/aps.56.2833 |