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Cui Yang, Li Jing, Zhang Lin. Electronic structure of graphene nanoribbons under external electric field by density functional tight binding. Acta Physica Sinica,
2021, 70(5): 053101.
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Jiang Yuan-Qi, Peng Ping. Electronic structures of stable Cu-centered Cu-Zr icosahedral clusters studied by density functional theory. Acta Physica Sinica,
2018, 67(13): 132101.
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Liu Qi, Guan Peng-Fei. First principle study on atomic structure of La65X35(X=Ni, Al) metallic glasses. Acta Physica Sinica,
2018, 67(17): 178101.
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2016, 65(13): 133101.
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Zou Xiao-Cui, Wu Mu-Sheng, Liu Gang, Ouyang Chu-Ying, Xu Bo. First-principles study on the electronic structures of β-SiC/carbon nanotube core-shell structures. Acta Physica Sinica,
2013, 62(10): 107101.
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Song Jian, Li Feng, Deng Kai-Ming, Xiao Chuan-Yun, Kan Er-Jun, Lu Rui-Feng, Wu Hai-Ping. Density functional study on the stability and electronic structure of single layer Si6H4Ph2. Acta Physica Sinica,
2012, 61(24): 246801.
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Song Jiu-Xu, Yang Yin-Tang, Guo Li-Xin, Wang Ping, Zhang Zhi-Yong. Investigation on influence of antisite defects on electronic structure and optical properties of silicon carbide nanotube. Acta Physica Sinica,
2012, 61(23): 237301.
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Lu Shuo, Zhang Yue, Shang Jia-Xiang. First principles study on structure and property of Si2 CN4(010) surface. Acta Physica Sinica,
2011, 60(2): 027302.
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Guo Gu-Qing, Yang Liang, Zhang Guo-Qing. Atomic structure of Zr48Cu45Al7 bulk metallic glass. Acta Physica Sinica,
2011, 60(1): 016103.
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Chen Liang, Xu Can, Zhang Xiao-Fang. Electronic properties of MgO nanotube clusters studied with density functional theory. Acta Physica Sinica,
2009, 58(3): 1603-1607.
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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.
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Song Jiu-Xu, Yang Yin-Tang, Liu Hong-Xia, Zhang Zhi-Yong. First-principles study of the electonic structure of nitrogen-doped silicon carbide nanotubes. Acta Physica Sinica,
2009, 58(7): 4883-4887.
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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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Chang Zhi-Wen, Wang Qing-Lin, Luo You-Hua. Effects of spin multiplicity on atomic structure of titanium trimer. Acta Physica Sinica,
2006, 55(9): 4553-4556.
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Jiang Min-Hao, Meng Xu-Jun. A Hartree-Fock-Slater-Boltzmann-Saha method for detailed atomic structure and equation of state of plasmas. Acta Physica Sinica,
2005, 54(2): 587-593.
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Li Yong-Hua, Xu Peng-Shou, Pan Hai-Bin, Xu Fa-Qiang, Xie Chang-Kun. First-principle study on GaN(1010) surface structure. Acta Physica Sinica,
2005, 54(1): 317-322.
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Xu Peng-Shou, Li Yong-Hua, Pan Hai-Bin. First principle study on β-SiC(001)-(2×1) surface structure. Acta Physica Sinica,
2005, 54(12): 5824-5829.
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Xie Chang-Kun, Xu Peng-Shou, Xu Fa-Qiang, Pan Hai-Bin. Ｆｉｒｓｔ ｐｒｉｎｃｉｐｌｅｓｓｔｕｄｙｏｎα ＳｉＣ (1 0 1 0 )ｓｕｒｆａｃｅｓｔｒｕｃｔｕｒｅ. Acta Physica Sinica,
2002, 51(12): 2804-2811.
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TONG HONG-YONG, GU MU, TANG XUE-FENG, LIANG LING, YAO MING-ZHEN. ELECTRONIC STRUCTURES OF PbWO4 CRYSTAL CALCULATED IN TERMS OF DENSITY FUNCTIONAL THEORY. Acta Physica Sinica,
2000, 49(8): 1545-1549.
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MENG XU-JUN, ZONG XIAO-PING, BAI YUN, SUN YONG-SHENG, ZHANG JING-LIN. SELF-CONSISTENT CALCULATION OF ATOMIC STRUCTURE FOR MIXTURE. Acta Physica Sinica,
2000, 49(11): 2133-2138.
doi: 10.7498/aps.49.2133
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