[1] |
Yang Zi-Hao, Liu Gang, Wu Mu-Sheng, Shi Jing, Ouyang Chu-Ying, Yang Shen-Bo, Xu Bo.Electronic structures and molecular doping of germanane regulated by hydrogen vacancy clusters. Acta Physica Sinica, 2023, 72(12): 127101.doi:10.7498/aps.72.20230170 |
[2] |
Zhou Jia-Jian, Zhang Yu-Wen, He Chao-Yu, Ouyang Tao, Li Jin, Tang Chao.First-principles study of structure prediction and electronic properties of two-dimensional SiP2allotropes. Acta Physica Sinica, 2022, 71(23): 236101.doi:10.7498/aps.71.20220853 |
[3] |
Chen Lu, Li Ye-Fei, Zheng Qiao-Ling, Liu Qing-Kun, Gao Yi-Min, Li Bo, Zhou Chang-Meng.Theoretical study of atomic relaxation, surface energy, electronic structure and properties of B2- and B19'-NiTi surfaces. Acta Physica Sinica, 2019, 68(5): 053101.doi:10.7498/aps.68.20181944 |
[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] |
Song Qing-Gong, Qin Guo-Shun, Yang Bao-Bao, Jiang Qing-Jie, Hu Xue-Lan.Impurity concentration effects on the structures, ductile and electronic properties of Zr-doped gamma-TiAl alloys. Acta Physica Sinica, 2016, 65(4): 046102.doi:10.7498/aps.65.046102 |
[6] |
Wu Li-Jun, Sui Qiang-Tao, Zhang Duo, Zhang Lin, Qi Yang.Computational study of structures and electronic properties of SimGen (m+n=9) clusters. Acta Physica Sinica, 2015, 64(4): 042102.doi:10.7498/aps.64.042102 |
[7] |
Ruan Wen, Yu Xiao-Guang, Xie An-Dong, Wu Dong-Lan, Luo Wen-Lang.Structural and electronic properties of the BnY (n=1-11) clusters. Acta Physica Sinica, 2014, 63(24): 243101.doi:10.7498/aps.63.243101 |
[8] |
Ruan Wen, Xie An-Dong, Yu Xiao-Guang, Wu Dong-Lan.Geometric structure and electronic characteristics of NaBn (n=19) clusters. Acta Physica Sinica, 2012, 61(4): 043102.doi:10.7498/aps.61.043102 |
[9] |
Ge Gui-Xian, Jing Qun, Cao Hai-Bin, Yang Zeng-Qiang, Tang Guang-Hui, Yan Hong-Xia.The study on structures and properties of Run and Run Au(n=112) clusters by density functional theory. Acta Physica Sinica, 2011, 60(10): 103102.doi:10.7498/aps.60.103102 |
[10] |
Zhang Xiu-Rong, Li Yang, Yang Xing.Theoretical study on structural and electronic properties of WnNim(n+m=8) clusters. Acta Physica Sinica, 2011, 60(10): 103601.doi:10.7498/aps.60.103601 |
[11] |
Gao Hong, Zhu Wei-Hua, Tang Chun-Mei, Geng Fang-Fang, Yao Chang-Da, Xu Yun-Ling, Deng Kai-Ming.Density functional calculation on the geometric structure and electronic properties of the endohedral fullerene N2@C60. Acta Physica Sinica, 2010, 59(3): 1707-1711.doi:10.7498/aps.59.1707 |
[12] |
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 |
[13] |
Liu Li-Ren, Lei Xue-Ling, Chen Hang, Zhu Heng-Jiang.Geometry and electronic properties of Bn(n=2—15) clusters. Acta Physica Sinica, 2009, 58(8): 5355-5361.doi:10.7498/aps.58.5355 |
[14] |
Ge Gui-Xian, Yang Zeng-Qiang, Cao Hai-Bin.Density functional study of the interaction of CO with nickel clusters. Acta Physica Sinica, 2009, 58(9): 6128-6133.doi:10.7498/aps.58.6128 |
[15] |
Ge Gui-Xian, Luo You-Hua.Density functional theory study of the structure and electronic properties of MgnOn(n=2—8) clusters. Acta Physica Sinica, 2008, 57(8): 4851-4856.doi:10.7498/aps.57.4851 |
[16] |
Jing Qun, Zhang Jun, Wang Qing-Lin, Luo You-Hua.First principles study of lowest energy structures and electronic properties of GenB(n=12—19) clusters. Acta Physica Sinica, 2007, 56(8): 4477-4483.doi:10.7498/aps.56.4477 |
[17] |
Wang Qing-Lin, Ge Gui-Xian, Zhao Wen-Jie, Lei Xue-Ling, Yan Yu-Li, Yang Zhi, Luo You-Hua.Density functional theory study on the structure and properties of CoBen(n=1—12) clusters. Acta Physica Sinica, 2007, 56(6): 3219-3226.doi:10.7498/aps.56.3219 |
[18] |
Ge Gui-Xian, Jing Qun, Yang Zhi, Yan Yu-Li, Lei Xue-Ling, Zhao Wen-Jie, Wang Qing-Lin, Luo You-Hua.First-principles study of the lowest energy structures and electronic properties of NaBen (n=1—12) clusters. Acta Physica Sinica, 2006, 55(9): 4548-4552.doi:10.7498/aps.55.4548 |
[19] |
Mao Hua-Ping, Wang Hong-Yan, Zhu Zheng-He, Tang Yong-Jian.Geometry and electronic properties of bimetallic AunY(n=1—9) clusters. Acta Physica Sinica, 2006, 55(9): 4542-4547.doi:10.7498/aps.55.4542 |
[20] |
Mao Hua-Ping, Ma Mei-Zhong.Geometry and electronic properties of Aun(n =2—9)clusters. Acta Physica Sinica, 2004, 53(6): 1766-1771.doi:10.7498/aps.53.1766 |