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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.
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Cao Qing-Song, Yuan Yong-Bo, Xiao Chuan-Yun, Lu Rui-Feng, Kan Er-Jun, Deng Kai-Ming. Density functional study on the geometric and electronic properties of C80H80. Acta Physica Sinica,
2012, 61(10): 106101.
doi: 10.7498/aps.61.106101
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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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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.
doi: 10.7498/aps.61.026101
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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.
doi: 10.7498/aps.60.053601
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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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Jin Rong, Chen Xiao-Hong. Structure and properties of ZrnPd clusters by density-functional theory. Acta Physica Sinica,
2010, 59(10): 6955-6962.
doi: 10.7498/aps.59.6955
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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.
doi: 10.7498/aps.59.1707
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Yang Jian, Wang Ni-Ying, Zhu Dong-Jiu, Chen Xuan, Deng Kai-Ming, Xiao Chuan-Yun. Density functional calculation of the geometric and magnetic properties of MPb10（M=Ti，V，Cr，Cu，Pd） clusters. Acta Physica Sinica,
2009, 58(5): 3112-3117.
doi: 10.7498/aps.58.3112
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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, 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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Chen Xuan, Peng Xia, Deng Kai-Ming, Xiao Chuan-Yun, Hu Feng-Lan, Tan Wei-Shi. The magnetism of M13-doped cagelike structure of gold clusters (M = Fe, Ti)：density functional calculations. Acta Physica Sinica,
2009, 58(8): 5370-5375.
doi: 10.7498/aps.58.5370
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Cao Qing-Song, Deng Kai-Ming, Chen Xuan, Tang Chun-Mei, Huang De-Cai. Density functional study on the geometric and electronic properties of MC20F20 （M=Li, Na, Be, Mg）. Acta Physica Sinica,
2009, 58(3): 1863-1869.
doi: 10.7498/aps.58.1863
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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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Jiang Yan-Ling, Fu Shi-You, Deng Kai-Ming, Tang Chun-Mei, Tan Wei-Shi, Huang De-Cai, Liu Yu-Zhen, Wu Hai-Ping. Density functional study on the structural and electronic properties of fullerene-barbituric acid and its dimmer. Acta Physica Sinica,
2008, 57(6): 3690-3697.
doi: 10.7498/aps.57.3690
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Bai Yu-Jie, Fu Shi-You, Deng Kai-Ming, Tang Chun-Mei, Chen Xuan, Tan Wei-Shi, Liu Yu-Zhen, Huang De-Cai. Density functional calculations on the geometric and electronic structures of the endohedral fullerene H2＠C60 and its dimmer. Acta Physica Sinica,
2008, 57(6): 3684-3689.
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. Electro-magnetic characteristics of Ti-50.8at%Ni in martensite transition. Acta Physica Sinica,
2007, 56(12): 7170-7175.
doi: 10.7498/aps.56.7170
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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.
doi: 10.7498/aps.56.5216
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Tang Chun-Mei, Yuan Yong-Bo, Deng Kai-Ming, Yang Jin-Long. Structural and electronic properties of C72 and La2@C72. Acta Physica Sinica,
2006, 55(7): 3601-3605.
doi: 10.7498/aps.55.3601
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