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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.
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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 SiP2 allotropes. Acta Physica Sinica,
2022, 71(23): 236101.
doi: 10.7498/aps.71.20220853
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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.
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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, 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.
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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.
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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.
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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.
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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.
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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.
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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.
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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.
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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.
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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.
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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.
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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.
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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.
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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.
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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.
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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.
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