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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 |
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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 |
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Song Qing-Gong, Zhao Jun-Pu, Gu Wei-Feng, Zhen Dan-Dan, Guo Yan-Rui, Li Ze-Peng.Ductile and electronic properties of La-doped gamma-TiAl systems based on density functional theory. Acta Physica Sinica, 2017, 66(6): 066103.doi:10.7498/aps.66.066103 |
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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 |
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Peng Jun-Hui, Zeng Qing-Feng, Xie Cong-Wei, Zhu Kai-Jin, Tan Jun-Hua.High-pressure structure prediction of Hf-C system and first-principle simulation of their electronic properties. Acta Physica Sinica, 2015, 64(23): 236102.doi:10.7498/aps.64.236102 |
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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 |
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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 |
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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 |
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Ge Gui-Xian, Yan Hong-Xia, Jing Qun, Zhang Jian-Jun.Density functional theory study on the structure and electronicproperties of Aun Sc3 (n =1—7) clusters. Acta Physica Sinica, 2011, 60(3): 033101.doi:10.7498/aps.60.033101 |
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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 |
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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 |
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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 |
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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 |
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Li Xi-Bo, Luo Jiang-Shan, Guo Yun-Dong, Wu Wei-Dong, Wang Hong-Yan, Tang Yong-Jian.Density functional theory study of the stability, electronic and magnetic properties of Scn, Yn and Lan (n＝2—10) clusters. Acta Physica Sinica, 2008, 57(8): 4857-4865.doi:10.7498/aps.57.4857 |
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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 |
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Tian Fu-Yang, Wang Yuan-Xu, Jing Qun, Tian Kai, Luo You-Hua.Density functional theory study of structures and electronic properties of XMgn (X=B, Al, n=1—12) clusters. Acta Physica Sinica, 2008, 57(3): 1648-1655.doi:10.7498/aps.57.1648 |
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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 |
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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 |
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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 |
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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 |
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