[1] |
Zheng Xu, Li Zhao, Gu Yue-Liang, Yin Shuai-Shuai, Jiang Ji-Chao, Guo Pu, Qiu Zhi-Yong, Li Xiao-Long.Surface structure of BaTiO3single crystal and the influence of pH value of liquid on its surface structure. Acta Physica Sinica, 2024, 73(10): 106101.doi:10.7498/aps.73.20240084 |
[2] |
Chen Xian, Wang Yan-Wu, Wang Xiao-Yan, An Shu-Dong, Wang Xiao-Bo, Zhao Yu-Qing.Effect of titanium ion energy on surface structure during the amorphous titanium dioxide film deposition. Acta Physica Sinica, 2014, 63(24): 246801.doi:10.7498/aps.63.246801 |
[3] |
Zhang Feng-Chun, Li Chun-Fu, Zhang Cong-Lei, Ran Zeng-Ling.Surface absorptions of H2S, HS and S on Fe(111) investigated by density functional theory. Acta Physica Sinica, 2014, 63(12): 127101.doi:10.7498/aps.63.127101 |
[4] |
Ran Run-Xin, Fan Xiao-Li, Yang Yong-Liang, Fang Xiao-Liang.Theoretical study of adsorption of propanethiol on Au(111) surface at different coverages. Acta Physica Sinica, 2013, 62(22): 223101.doi:10.7498/aps.62.223101 |
[5] |
Shu Yu, Zhang Yan, Zhang Jian-Min.First-principles analysis of properties of Cu surfaces. Acta Physica Sinica, 2012, 61(1): 016108.doi:10.7498/aps.61.016108 |
[6] |
Yuan Jian-Mei, Hao Wen-Ping, Li Shun-Hui, Mao Yu-Liang.Density functional study on the adsorption of C atoms on Ni (111) surface. Acta Physica Sinica, 2012, 61(8): 087301.doi:10.7498/aps.61.087301 |
[7] |
Fang Li-Min.First principles study of interactions between Au and N atoms on SrTiO3(001) surface. Acta Physica Sinica, 2011, 60(5): 056801.doi:10.7498/aps.60.056801 |
[8] |
Chen Gong-Bao, Lu Wen-Jiang, Tang Fu-Ling, Xie Yong.Liquid-like structure and self-diffusion channels on Al surfaces. Acta Physica Sinica, 2011, 60(6): 066801.doi:10.7498/aps.60.066801 |
[9] |
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 |
[10] |
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.doi:10.7498/aps.59.7830 |
[11] |
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 |
[12] |
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.doi:10.7498/aps.58.3331 |
[13] |
Meng Da-Qiao, Luo Wen-Hua, Li Gan, Chen Hu-Chi.Density functional study of CO2 adsorption on Pu(100) surface. Acta Physica Sinica, 2009, 58(12): 8224-8229.doi:10.7498/aps.58.8224 |
[14] |
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.doi:10.7498/aps.58.193 |
[15] |
Xiao Bing, Feng Jing, Chen Jing-Chao, Yan Ji-Kang, Gan Guo-You.Study of rutile (110) surface STM image via ab initio simulation. Acta Physica Sinica, 2008, 57(6): 3769-3774.doi:10.7498/aps.57.3769 |
[16] |
Ma Xin-Guo, Tang Chao-Qun, Huang Jin-Qiu, Hu Lian-Feng, Xue Xia, Zhou Wen-Bin.First-principle calculations on the geometry and relaxation structure of anatase TiO2(101) surface. Acta Physica Sinica, 2006, 55(8): 4208-4213.doi:10.7498/aps.55.4208 |
[17] |
Zeng Zhen-Hua, Deng Hui-Qiu, Li Wei-Xue, Hu Wang-Yu.Density function theory calculation of oxygen adsorption on Au(111) surface. Acta Physica Sinica, 2006, 55(6): 3157-3164.doi:10.7498/aps.55.3157 |
[18] |
Wang Chang-Qing, Jia Yu, Ma Bing-Xian, Wang Song-You, Qin Zhen, Wang Fei, Wu Le-Ke, Li Xin-Jian.Molecular dynamics simulations of various metastable structures on Si(001) at different temperatures. Acta Physica Sinica, 2005, 54(9): 4313-4318.doi:10.7498/aps.54.4313 |
[19] |
Yang Chun, Li Yan-Rong, Xue Wei-Dong, Tao Bai-Wan, Liu Xing-Zhao, Zhang Ying, Huang Wei.Study on the structure and energy of the (0001) surface of α-Al2O3 substrate. Acta Physica Sinica, 2003, 52(9): 2268-2273.doi:10.7498/aps.52.2268 |
[20] |
TU XIU-WEN, GAI ZHENG.ATOMIC STRUCTURE OF THE Ge(112)-(4×1)-In RECONSTRUCTION. Acta Physica Sinica, 2001, 50(12): 2439-2445.doi:10.7498/aps.50.2439 |