[1] |
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.doi:10.7498/aps.70.20201619 |
[2] |
Shi Bin, Yuan Li, Tang Tian-Yu, Lu Li-Min, Zhao Xian-Hao, Wei Xiao-Nan, Tang Yan-Lin.Spectral analysis and density functional theory study of tert-butylhydroquinone. Acta Physica Sinica, 2021, 70(5): 053102.doi:10.7498/aps.70.20201555 |
[3] |
Li Ya-Sha, Sun Lin-Xiang, Zhou Xiao, Chen Kai, Wang Hui-Yao.Structure and excitation characteristics of C5F10O under external electric field based on density functional theory. Acta Physica Sinica, 2020, 69(1): 013101.doi:10.7498/aps.69.20191455 |
[4] |
Li Yan, Zhang Lin-Bin, Li Jiao, Lian Xiao-Xue, Zhu Jun-Wu.Crystallization characteristics of zinc oxide under electric field and Raman spectrum analysis of polarized products. Acta Physica Sinica, 2019, 68(7): 070701.doi:10.7498/aps.68.20181961 |
[5] |
Du Jian-Bin, Feng Zhi-Fang, Zhang Qian, Han Li-Jun, Tang Yan-Lin, Li Qi-Feng.Molecular structure and electronic spectrum of MoS2under external electric field. Acta Physica Sinica, 2019, 68(17): 173101.doi:10.7498/aps.68.20190781 |
[6] |
Li Ya-Sha, Xie Yun-Long, Huang Tai-Huan, Xu Cheng, Liu Guo-Cheng.Molecular structure and properties of salt cross-linked polyethylene under external electric field based on density functional theory. Acta Physica Sinica, 2018, 67(18): 183101.doi:10.7498/aps.67.20180808 |
[7] |
Du Jian-Bin, Feng Zhi-Fang, Han Li-Jun, Tang Yan-Lin, Wu De-Qi.Molecular structure and electronic spectrum of C12H4Cl4O2 under external electric field. Acta Physica Sinica, 2018, 67(22): 223101.doi:10.7498/aps.67.20181454 |
[8] |
Li Shi-Xiong, Zhang Zheng-Ping, Long Zheng-Wen, Qin Shui-Jie.Ground state properties and spectral properties of borospherene B40 under different external electric fields. Acta Physica Sinica, 2017, 66(10): 103102.doi:10.7498/aps.66.103102 |
[9] |
Lu Tao, Wang Jin, Fu Xu, Xu Biao, Ye Fei-Hong, Mao Jin-Bin, Lu Yun-Qing, Xu Ji.Theoretical calculation of the birefringence of poly-methyl methacrylate by using the density functional theory and molecular dynamics method. Acta Physica Sinica, 2016, 65(21): 210301.doi:10.7498/aps.65.210301 |
[10] |
Yang Tao, Liu Dai-Jun, Chen Jian-Jun.Molecular structure and properties of sulfur dioxide under the external electric field. Acta Physica Sinica, 2016, 65(5): 053101.doi:10.7498/aps.65.053101 |
[11] |
Du Jian-Bin, Wu De-Qi, Tang Yan-Lin, Long Zheng-Wen.Molecular structure and spectrum of dibutyl phthalate in an external electric field. Acta Physica Sinica, 2015, 64(7): 073101.doi:10.7498/aps.64.073101 |
[12] |
Wu Yong-Gang, Li Shi-Xiong, Hao Jin-Xin, Xu Mei, Sun Guang-Yu, Linghu Rong-Feng.Properties of ground state and spectrum of CdSe in different external electric fields. Acta Physica Sinica, 2015, 64(15): 153102.doi:10.7498/aps.64.153102 |
[13] |
Wen Jun-Qing, Zhang Jian-Min, Yao Pan, Zhou Hong, Wang Jun-Fei.A density functional theory study of small bimetallic PdnAl (n =18) clusters. Acta Physica Sinica, 2014, 63(11): 113101.doi:10.7498/aps.63.113101 |
[14] |
Cao Xin-Wei, Ren Yang, Liu Hui, Li Shu-Li.Molecular structure and excited states for BN under strong electric field. Acta Physica Sinica, 2014, 63(4): 043101.doi:10.7498/aps.63.043101 |
[15] |
Li Tao, Tang Yan-Lin, Ling Zhi-Gang, Li Yu-Peng, Long Zhen-Wen.Influence of external electric field on the molecular structure and electronic spectrum of paranitrochlorobenzene. Acta Physica Sinica, 2013, 62(10): 103103.doi:10.7498/aps.62.103103 |
[16] |
Du Jian-Bin, Tang Yan-Lin, Long Zhen-Wen.Molecular structure and electronic spectrum of pentachlorophenol in the external electric field. Acta Physica Sinica, 2012, 61(15): 153101.doi:10.7498/aps.61.153101 |
[17] |
Gao Tao, Zhou Jing-Jing, Chen Yun-Gui, Wu Chao-Ling, Xiao Yan.Spatial configurations and X-ray absorption of Ti catalyzing on NaAlH4 surfaces: Car-Parrinello molecular dynamics and density functional theory study. Acta Physica Sinica, 2010, 59(10): 7452-7457.doi:10.7498/aps.59.7452 |
[18] |
He Jian-Yong, Long Zheng-Wen, Long Chao-Yun, Cai Shao-Hong.Molecular structure and electronic spectrum of CaS under electric fields. Acta Physica Sinica, 2010, 59(3): 1651-1657.doi:10.7498/aps.59.1651 |
[19] |
Yan An-Ying, Jiang Ming, Zhang Chuan-Wu, Miao Feng, Gou Fu-Jun.Energy and spectrum of BeO molecule under the electric field from different directions. Acta Physica Sinica, 2010, 59(11): 7743-7748.doi:10.7498/aps.59.7743 |
[20] |
Xu Guo-Liang, Lü Wen-Jing, Liu Yu-Fang, Zhu Zun-Lüe, Zhang Xian-Zhou, Sun Jin-Feng.Effect of external electric field on the optical excitation of silicon dioxide. Acta Physica Sinica, 2009, 58(5): 3058-3063.doi:10.7498/aps.58.3058 |