[1] |
Dong Xiao.Density functional theory on reaction mechanism between p-doped LiNH2clusters and LiH and a new hydrogen storage and desorption mechanism. Acta Physica Sinica, 2023, 72(15): 153101.doi:10.7498/aps.72.20230374 |
[2] |
Li Gao-Fang, Yin Wen, Huang Jing-Guo, Cui Hao-Yang, Ye Han-Jing, Gao Yan-Qing, Huang Zhi-Ming, Chu Jun-Hao.Conductivity in sulfur doped gallium selenide crystals measured by terahertz time-domain spectroscopy. Acta Physica Sinica, 2023, 72(4): 047801.doi:10.7498/aps.72.20221548 |
[3] |
Du Jian-Bin, Zhang Qian, Li Qi-Feng, Tang Yan-Lin.Investigation of external electric field effect on C24H38O4 molecule by density functional theory. Acta Physica Sinica, 2018, 67(6): 063102.doi:10.7498/aps.67.20172022 |
[4] |
Chen Mei-Na, Zhang Lei, Gao Hui-Ying, Xuan Yan, Ren Jun-Feng, Lin Zi-Jing.DFT+U calculation of Sm3+ and Sr2+ co-doping effect on performance of CeO2-based electrolyte. Acta Physica Sinica, 2018, 67(8): 088202.doi:10.7498/aps.67.20172748 |
[5] |
Feng Qiu-Ju, Li Fang, Li Tong-Tong, Li Yun-Zheng, Shi Bo, Li Meng-Ke, Liang Hong-Wei.Growth and characterization of grid-like β-Ga2O3 nanowires by electric field assisted chemical vapor deposition method. Acta Physica Sinica, 2018, 67(21): 218101.doi:10.7498/aps.67.20180805 |
[6] |
Dai Guang-Zhen, Jiang Xian-Wei, Xu Tai-Long, Liu Qi, Chen Jun-Ning, Dai Yue-Hua.Effect of oxygen vacancy on lattice and electronic properties of HfO2 by means of density function theory study. Acta Physica Sinica, 2015, 64(3): 033101.doi:10.7498/aps.64.033101 |
[7] |
Yang Zhen-Qing, Bai Xiao-Hui, Shao Chang-Jin.Density functional theory studies of (TiO2)12 quantum ring and its electronic properties when doped with transition metal compounds. Acta Physica Sinica, 2015, 64(7): 077102.doi:10.7498/aps.64.077102 |
[8] |
Lü Jin, Yang Li-Jun, Wang Yan-Fang, Ma Wen-Jin.Density functional theory study of structure characteristics and stabilities of Al2Sn(n=2-10) clusters. Acta Physica Sinica, 2014, 63(16): 163601.doi:10.7498/aps.63.163601 |
[9] |
Zhu Hui-Qun, Li Yi, Ye Wei-Jie, Li Chun-Bo.Thermochromic properties of W-doped VO2/ZnO nanocomposite films with flower structures. Acta Physica Sinica, 2014, 63(23): 238101.doi:10.7498/aps.63.238101 |
[10] |
Tong Guo-Xiang, Li Yi, Wang Feng, Huang Yi-Ze, Fang Bao-Ying, Wang Xiao-Hua, Zhu Hui-Qun, Liang Qian, Yan Meng, Qin Yuan, Ding Jie, Chen Shao-Juan, Chen Jian-Kun, Zheng Hong-Zhu, Yuan Wen-Rui.Preparation of W-doped VO2/FTO composite thin films by DC magnetron sputtering and characterization analyses of the films. Acta Physica Sinica, 2013, 62(20): 208102.doi:10.7498/aps.62.208102 |
[11] |
Zhang Bei, Bao An, Chen Chu, Zhang Jun.Density-functional theory study of ConCm (n=15, m=1,2) clusters. Acta Physica Sinica, 2012, 61(15): 153601.doi:10.7498/aps.61.153601 |
[12] |
Xie Xiao-Dong, Hao Yu-Ying, Zhang Ri-Guang, Wang Bao-Jun.Lithium-doped tris (8-hydroxyquinoline) aluminum studied by density functional theory. Acta Physica Sinica, 2012, 61(12): 127201.doi:10.7498/aps.61.127201 |
[13] |
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 |
[14] |
Liu Jian-Jun.First-principles calculation of electronic structure of (Zn,Al)O and analysis of its conductivity. Acta Physica Sinica, 2011, 60(3): 037102.doi:10.7498/aps.60.037102 |
[15] |
Tan Man-Lin, Zhu Jia-Qi, Zhang Hua-Yu, Zhu Zhen-Ye, Han Jie-Cai.Effect of boron doping on the electrical conduction of tetrahedral amorphous carbon films. Acta Physica Sinica, 2008, 57(10): 6551-6556.doi:10.7498/aps.57.6551 |
[16] |
Chen Yu-Hong, Kang Long, Zhang Cai-Rong, Luo Yong-Chun, Ma Jun.Density functional theory study of [Mg(NH2)2]n(n=1—5) clusters. Acta Physica Sinica, 2008, 57(8): 4866-4874.doi:10.7498/aps.57.4866 |
[17] |
Yang Feng-Xia, Zhang Duan-Ming, Deng Zong-Wei, Jiang Sheng-Lin, Xu Jie, Li Shu-Dan.The influence of the matrix electrical conductivity on the dc poling behaviors and the loss of 0-3 ferroelectric composites. Acta Physica Sinica, 2008, 57(6): 3840-3845.doi:10.7498/aps.57.3840 |
[18] |
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 |
[19] |
Zeng Zhen-Hua, Deng Hui-Qiu, Li Wei-Xue, Hu Wang-Yu.Density function theory calculation of oxygen adsorption on Au(111) surface. Acta Physica Sinica, 2006, 55(6): 3157-3164.doi:10.7498/aps.55.3157 |
[20] |
Xu Ren-Xin, Chen Wen, Zhou Jing.Effect of polymer conductance on polarization properties of 0-3 piezoelectric composite. Acta Physica Sinica, 2006, 55(8): 4292-4297.doi:10.7498/aps.55.4292 |