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Xu Xian-Da, Zhao Lei, Sun Wei-Feng. First-principles on the energy band mechanism for modifying conduction property of graphene nanomeshes. Acta Physica Sinica,
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Li Lin, Sun Yu-Xuan, Sun Wei-Feng. First-principles study of electronic structure, magnetic and optical properties of laminated molybdenum oxides. Acta Physica Sinica,
2019, 68(5): 057101.
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Chi Ming-He, Zhao Lei. First-principles study of magnetic order in graphene nanoflakes as spin logic devices. Acta Physica Sinica,
2018, 67(21): 217101.
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Zhang Yun, Wang Xue-Wei, Bai Hong-Mei. First-principles study on the electronic structures and the absorption spectra of In: Mn: LiNbO3 crystals. Acta Physica Sinica,
2017, 66(2): 024208.
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Wu Ruo-Xi, Liu Dai-Jun, Yu Yang, Yang Tao. First-principles investigations on structure and thermodynamic properties of CaS under high pressures. Acta Physica Sinica,
2016, 65(2): 027101.
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Gao Tan-Hua. Structural and electronic properties of hydrogenated bilayer silicene. Acta Physica Sinica,
2015, 64(7): 076801.
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Wang Jin-Rong, Zhu Jun, Hao Yan-Jun, Ji Guang-Fu, Xiang Gang, Zou Yang-Chun. First-principles study of the structural, elastic and electronic properties of RhB under high pressure. Acta Physica Sinica,
2014, 63(18): 186401.
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2014, 63(1): 016801.
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Zhang Yang, Huang Yan, Chen Xiao-Shuang, Lu Wei. The study of oxygen and sulfur adsorption on the InSb (110) surface, using first-principle energy calculations. Acta Physica Sinica,
2013, 62(20): 206102.
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Wang Ru-Zhi, Xu Li-Chun, Yan Hui, Kohyama Masanori. First-principles predictions for the tensile strength of Al metal with dislocations of twist grain boundaries. Acta Physica Sinica,
2012, 61(2): 026801.
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Li Rong, Luo Xiao-Ling, Liang Guo-Ming, Fu Wen-Sheng. Influence of doped rare earth elements on the dehydrogenation properties of VH2. Acta Physica Sinica,
2012, 61(9): 093601.
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Gao Tan-Hua, Liu Hui-Ying, Zhang Peng, Wu Shun-Qing, Yang Yong, Zhu Zi-Zhong. Structural and electronic properties of Al-doped spinel LiMn2O4. Acta Physica Sinica,
2012, 61(18): 187306.
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Liu Jian-Jun. First-principles calculation of electronic structure of (Zn,Al)O and analysis of its conductivity. Acta Physica Sinica,
2011, 60(3): 037102.
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Ji Zheng-Hua, Zeng Xiang-Hua, Cen Jie-Ping, Tan Ming-Qiu. Electronic structure and phase transformation in ZnSe: An ab initio study. Acta Physica Sinica,
2010, 59(2): 1219-1224.
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Zhou Long, Li Han, Su Xian-Li, Tang Xin-Feng. Effects of In doping on crystal structure and thermoelectric properties of n-type skutterudites. Acta Physica Sinica,
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Wang Song-You, Duan Guo-Yu, Qiu Jian-Hong, Jia Yu, Chen Liang-Yao. PtN in zinc-blende structure: An unstable metallic transition-metal nitride compound. Acta Physica Sinica,
2006, 55(4): 1979-1982.
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Meng Xing, Xu Xiao-Guang, Liu Wei, Sun Yuan, Chen Gang. First-principles investigation of charge disproportionation in HoNiO＿3 perovskite. Acta Physica Sinica,
2004, 53(11): 3873-3876.
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Liu Hui-Ying, Hou Zhu-Feng, Zhu Zi-Zhong, Huang Mei-Chun, Yang Yong. Ab initiocalculation of the voltage profile curve of Li insertions in InSb. Acta Physica Sinica,
2004, 53(11): 3868-3872.
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Chen Li-Juan, Hou Zhu-Feng, Zhu Zi-Zhong, Yang Yong. First-principles calculation of the vacancy formation energies in LiAl. Acta Physica Sinica,
2003, 52(9): 2229-2234.
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