[1] |
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 |
[2] |
Li Yuan-Yuan, Hu Zhu-Bin, Sun Hai-Tao, Sun Zhen-Rong.Density functional theory studies on the excited-state properties of Bilirubin molecule. Acta Physica Sinica, 2020, 69(16): 163101.doi:10.7498/aps.69.20200518 |
[3] |
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 |
[4] |
Luo Qiang, Yang Heng, Guo Ping, Zhao Jian-Fei.Density functional theory calculation of structure and electronic properties in N-methane hydrate. Acta Physica Sinica, 2019, 68(16): 169101.doi:10.7498/aps.68.20182230 |
[5] |
Yu Ben-Hai, Chen Dong.Phase transition, electronic and optical properties of Si3N4 new phases at high pressure with density functional theory. Acta Physica Sinica, 2014, 63(4): 047101.doi:10.7498/aps.63.047101 |
[6] |
Liu Na-Na, Sun Jian-Lin, Xia Lei, Zeng Ying-Feng.Adsorption behavior of inhibitor on copper surface. Acta Physica Sinica, 2013, 62(20): 203102.doi:10.7498/aps.62.203102 |
[7] |
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 |
[8] |
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 |
[9] |
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 |
[10] |
Zhang Zhi-Long, Chen Yu-Hong, Ren Bao-Xing, Zhang Cai-Rong, Du Rui, Wang Wei-Chao.Density functional theory study on the structure and properties of (HMgN3)n(n=15) clusters. Acta Physica Sinica, 2011, 60(12): 123601.doi:10.7498/aps.60.123601 |
[11] |
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 |
[12] |
Li Xue-Mei, Han Hui-Lei, He Guang-Pu.Lattice dynamical, dielectric and thermodynamic properties of LiNH2 from first principles. Acta Physica Sinica, 2011, 60(8): 087104.doi:10.7498/aps.60.087104 |
[13] |
Jin Rong, Chen Xiao-Hong.Structure and properties of ZrnPd clusters by density-functional theory. Acta Physica Sinica, 2010, 59(10): 6955-6962.doi:10.7498/aps.59.6955 |
[14] |
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 |
[15] |
Li Xi-Bo, Wang Hong-Yan, Luo Jiang-Shan, Wu Wei-Dong, Tang Yong-Jian.Density functional theory study of the geometry, stability and electronic properties of ScnO(n=1—9) clusters. Acta Physica Sinica, 2009, 58(9): 6134-6140.doi:10.7498/aps.58.6134 |
[16] |
Wang Na, Tang Bi-Yu.Structural,elastic and electronic properties of L12 aluminum phases from first principles calculation. Acta Physica Sinica, 2009, 58(13): 230-S234.doi:10.7498/aps.58.230 |
[17] |
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 |
[18] |
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 |
[19] |
Chen Yu-Hong, Zhang Cai-Rong, Ma Jun.Density functional theory study on the structure and properties of MgmBn(m=1,2;n=1—4) clusters. Acta Physica Sinica, 2006, 55(1): 171-178.doi:10.7498/aps.55.171 |
[20] |
Li Zheng-Fa, Zhang Pei-Lin, Zhao Ming-Lei, Wang Chun-Lei, Zhong Wei-Lie, Wang Zeng-Mei, Yuan Duo-Rong.Dielectric,elastic and piezoelectric properties of La3Ga5SiO14 crystal. Acta Physica Sinica, 2003, 52(3): 726-728.doi:10.7498/aps.52.726 |