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Zhao Ming-Hui, Liu Zhong-Jun, Ji Shuai, Liu Chen, Ao Qing-Bo. GCMC simulation of supercritical N2 adsorption in single-walled carbon nanotubes. Acta Physica Sinica,
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Wang Ya-Jing, Li Gui-Xia, Wang Zhi-Hua, Gong Li-Ji, Wang Xiu-Fang. Diameter monodispersity of imogolite-like nanotube: a density functional theory study. Acta Physica Sinica,
2016, 65(4): 048101.
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Sun Jian-Ping, Zhou Ke-Liang, Liang Xiao-Dong. Density functional study on the adsorption characteristics of O, O2, OH, and OOH of B-, P-doped, and B, P codoped graphenes. Acta Physica Sinica,
2016, 65(1): 018201.
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He Yan-Bin, Jia Jian-Feng, Wu Hai-Shun. First-principles study of stability and electronic structure of N2H4 adsorption on NiFe(111) alloy surface. Acta Physica Sinica,
2015, 64(20): 203101.
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Sun Jian-Ping, Miao Ying-Meng, Cao Xiang-Chun. Density functional theory studies of O2 and CO adsorption on the graphene doped with Pd. Acta Physica Sinica,
2013, 62(3): 036301.
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Xu Ying-Ying, Kan Yu-He, Wu Jie, Tao Wei, Su Zhong-Min. Theoretical study on the electronic structures and photophysical properties of carbon nanorings and their analogues. Acta Physica Sinica,
2013, 62(8): 083101.
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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,
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Lv Bing, Linghu Rong-Feng, Song Xiao-Shu, Wang Xiao-Lu, Yang Xiang-Dong, He Duan-Wei. Adsorption and diffusion of oxygen on Pt (111) surface and subsurface. Acta Physica Sinica,
2012, 61(7): 076802.
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Huang Ping, Yang Chun. Theoretical research of TiO2 adsorption on GaN(0001) surface. Acta Physica Sinica,
2011, 60(10): 106801.
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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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Sun Jian-Min, Zhao Gao-Feng, Wang Xian-Wei, Yang Wen, Liu Yan, Wang Yuan-Xu. Study of structural and electronic properties of Cu-adsorbed (SiO2)n(n=1—8) clusters with the DFT. Acta Physica Sinica,
2010, 59(11): 7830-7837.
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Zhang Jian-Jun, Zhang Hong. A low coverage investigation on Al adsorption on the (111) surface of Pt, Ir and Au. Acta Physica Sinica,
2010, 59(6): 4143-4149.
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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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Wang Liu-Ding, Chen Guo-Dong, Zhang Jiao-Qiang, Yang Min, Wang Yi-Jun, An Bo. First-principles study on field emission properties of carbon nanocone. Acta Physica Sinica,
2009, 58(11): 7852-7856.
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Yang Min, Wang Liu-Ding, Chen Guo-Dong, An Bo, Wang Yi-Jun, Liu Guang-Qing. First-principles study on field emission of C-doped capped single-walled BNNT. Acta Physica Sinica,
2009, 58(10): 7151-7155.
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Lin Feng, Zheng Fa-Wei, Ouyang Fang-Ping. A density functional theory study on water adsorption on TiO2-terminated SrTiO3（001） surface. Acta Physica Sinica,
2009, 58(13): 193-S198.
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Yang Pei-Fang, Hu Juan-Mei, Teng Bo-Tao, Wu Feng-Min, Jiang Shi-Yu. Density functional theory study of rhodium adsorption on single-wall carbon nanotubes. Acta Physica Sinica,
2009, 58(5): 3331-3337.
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Chen Guo-Dong, Wang Liu-Ding, An Bo, Yang Min, Cao De-Cai, Liu Guang-Qing. First-principles study of electron field emission from the carbon nanotube with nitrogen doping and H2O adsorption. Acta Physica Sinica,
2009, 58(2): 1190-1194.
doi: 10.7498/aps.58.1190
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