[1] |
Yan Zhi, Fang Cheng, Wang Fang, Xu Xiao-Hong.First-principles calculations of structural and magnetic properties of SmCo3alloys doped with transition metal elements. Acta Physica Sinica, 2024, 73(3): 037502.doi:10.7498/aps.73.20231436 |
[2] |
Ding Li-Jie, Zhang Xiao-Tian, Guo Xin-Yi, Xue Yang, Lin Chang-Qing, Huang Dan.First-principles study of SrSnO3as transparent conductive oxide. Acta Physica Sinica, 2023, 72(1): 013101.doi:10.7498/aps.72.20221544 |
[3] |
Yang Hai-Lin, Chen Qi-Li, Gu Xing, Lin Ning.First-principles calculations of O-atom diffusion on fluorinated graphene. Acta Physica Sinica, 2023, 72(1): 016801.doi:10.7498/aps.72.20221630 |
[4] |
Shi Xiao-Hong, Chen Jing-Jin, Cao Xin-Rui, Wu Shun-Qing, Zhu Zi-Zhong.Formation of oxygen vacancies in Li-rich Mn-based cathode material Li1.167Ni0.167Co0.167Mn0.5O2. Acta Physica Sinica, 2022, 71(17): 178202.doi:10.7498/aps.71.20220274 |
[5] |
Zheng Lu-Min, Zhong Shu-Ying, Xu Bo, Ouyang Chu-Ying.First-principles study of rare-earth-doped cathode materials Li2MnO3in Li-ion batteries. Acta Physica Sinica, 2019, 68(13): 138201.doi:10.7498/aps.68.20190509 |
[6] |
Huang Bing-Quan, Zhou Tie-Ge, Wu Dao-Xiong, Zhang Zhao-Fu, Li Bai-Kui.Properties of vacancies and N-doping in monolayer g-ZnO: First-principles calculation and molecular orbital theory analysis. Acta Physica Sinica, 2019, 68(24): 246301.doi:10.7498/aps.68.20191258 |
[7] |
Chen Ya-Qi, Xu Hua-Kai, Tang Dong-Sheng, Yu Fang, Lei Le, Ouyang Gang.Electrical transport properties and related mechanism of single SnO2nanowire device. Acta Physica Sinica, 2018, 67(24): 246801.doi:10.7498/aps.67.20181402 |
[8] |
Zhao Run, Yang Hao.Oxygen vacancies induced tuning effect on physical properties of multiferroic perovskite oxide thin films. Acta Physica Sinica, 2018, 67(15): 156101.doi:10.7498/aps.67.20181028 |
[9] |
He Jin-Yun, Peng Dai-Jiang, Wang Yan-Wu, Long Fei, Zou Zheng-Guang.First principle calculation and photocatalytic performance of BixWO6 (1.81 ≤ x ≤ 2.01) with oxygen vacancies. Acta Physica Sinica, 2018, 67(6): 066801.doi:10.7498/aps.67.20172287 |
[10] |
Jiang Ping-Guo, Wang Zheng-Bing, Yan Yong-Bo, Liu Wen-Jie.First-principles study of absorption mechanism of hydrogen on W20O58 (010) surface. Acta Physica Sinica, 2017, 66(24): 246801.doi:10.7498/aps.66.246801 |
[11] |
Ye Hong-Jun, Wang Da-Wei, Jiang Zhi-Jun, Cheng Sheng, Wei Xiao-Yong.Ferroelectric phase transition of perovskite SnTiO3 based on the first principles. Acta Physica Sinica, 2016, 65(23): 237101.doi:10.7498/aps.65.237101 |
[12] |
Jiang Ran, Du Xiang-Hao, Han Zu-Yin, Sun Wei-Deng.Cluster distribution for oxygen vacancy in Ti/HfO2/Pt resistive switching memory device. Acta Physica Sinica, 2015, 64(20): 207302.doi:10.7498/aps.64.207302 |
[13] |
Dai Guang-Zhen, Dai Yue-Hua, Xu Tai-Long, Wang Jia-Yu, Zhao Yuan-Yang, Chen Jun-Ning, Liu Qi.First principles study on influence of oxygen vacancy in HfO2 on charge trapping memory. Acta Physica Sinica, 2014, 63(12): 123101.doi:10.7498/aps.63.123101 |
[14] |
Zhang Zhao-Fu, Zhou Tie-Ge, Zuo Xu.First-principles calculations of h-BN monolayers by doping with oxygen and sulfur. Acta Physica Sinica, 2013, 62(8): 083102.doi:10.7498/aps.62.083102 |
[15] |
Gong Yu, Chen Bai-Hua, Xiong Liang-Ping, Gu Mei, Xiong Jie, Gao Xiao-Ling, Luo Yang-Ming, Hu Sheng, Wang Yu-Hua.Effect of oxygen vacancies on the fluorescence and phosphorescence properties of Ca5MgSi3O12:Eu2+, Dy3+. Acta Physica Sinica, 2013, 62(15): 153201.doi:10.7498/aps.62.153201 |
[16] |
Ma Li-Sha, Zhang Qian-Cheng, Cheng Lin.First-principles calculations on electronic structures of Zn adsorbed on the anatase TiO2 (101) surface having oxygen vacancy and hydroxyl groups. Acta Physica Sinica, 2013, 62(18): 187101.doi:10.7498/aps.62.187101 |
[17] |
Yang Chang-Ping, Li Min-Yi, Song Xue-Ping, Xiao Hai-Bo, Xu Ling-Fang.Effect of oxygen content on giant dielectric constant and dielectric process in CaCu3Ti4O12. Acta Physica Sinica, 2012, 61(19): 197702.doi:10.7498/aps.61.197702 |
[18] |
Hu Fang, Ming Xing, Fan Hou-Gang, Chen Gang, Wang Chun-Zhong, Wei Ying-Jin, Huang Zu-Fei.First-principles study on the electronic structures of the ladder compound NaV2O4F. Acta Physica Sinica, 2009, 58(2): 1173-1178.doi:10.7498/aps.58.1173 |
[19] |
Ming Xing, Fan Hou-Gang, Hu Fang, Wang Chun-Zhong, Meng Xing, Huang Zu-Fei, Chen Gang.First-principles study on the electronic structures of spin-Peierls compound GeCuO3. Acta Physica Sinica, 2008, 57(4): 2368-2373.doi:10.7498/aps.57.2368 |
[20] |
Hou Qing-Yu, Zhang Yue, Chen Yue, Shang Jia-Xiang, Gu Jing-Hua.Effects of the concentration of oxygen vacancy of anatase on electric conducting performance studied by frist principles calculations. Acta Physica Sinica, 2008, 57(1): 438-442.doi:10.7498/aps.57.438 |