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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.
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Cao Qing-Song, Deng Kai-Ming. Theoretical studies of geometric and electronic structures of X@C20F20 (X=He, Ne, Ar, Kr). Acta Physica Sinica,
2016, 65(5): 056102.
doi: 10.7498/aps.65.056102
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Li Xin, Zhang Liang, Yang Meng-Shi, Chu Xiu-Xiang, Xu Can, Chen Liang, Wang Yue-Yue. Theoretical study on geometry and physical and chemical properties of oligochitosan. Acta Physica Sinica,
2014, 63(7): 076102.
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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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Tang Chun-Mei, Guo Wei, Zhu Wei-Hua, Liu Ming-Yi, Zhang Ai-Mei, Gong Jiang-Feng, Wang Hui. Density functional calculations of geomatric structure, electronic structure, stability, and magnetic properties of transitional atom endohedral unclassical fullerene M@C22(M=Sc,Ti, V, Cr, Mn, Fe, Co and Ni). Acta Physica Sinica,
2012, 61(2): 026101.
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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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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.
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Tang Hui-Shuai, Zhang Xiu-Rong, Kang Zhang-Li, Wu Li-Qing. Theoretical study of geometry structures and stability of OsnN0,±(n=1—6) clusters. Acta Physica Sinica,
2011, 60(5): 053601.
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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.
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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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Jin Rong, Chen Xiao-Hong. Structure and properties of ZrnPd clusters by density-functional theory. Acta Physica Sinica,
2010, 59(10): 6955-6962.
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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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Tang Chun-Mei, Zhu Wei-Hua, Deng Kai-Ming. Density functional calculations on the structure, bonding and magnetic properties of the transition metal atom doped endohedral fullerene Ni@C20H20. Acta Physica Sinica,
2009, 58(7): 4567-4572.
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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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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.
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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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Chen Xuan, Lu Gong-Li, Tang Chun-Mei, Deng Kai-Ming, Tan Wei-Shi. Geometric structures, electronic properties, and magnetism of M2Sn17(M=Ni，Mn)and their anions. Acta Physica Sinica,
2007, 56(9): 5216-5220.
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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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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
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