Estimate bond angle dependence of superconducting transition temperature in NaFeAs with the first principle methods | |
Sun, Tieyu1; Huang, Haitao1; Peng, Biaolin1; Zheng, Renkui1,2; Lam, Chi-Hang1; Tang, Tao1,3; Wang, Yu1 | |
刊名 | SOLID STATE COMMUNICATIONS |
2016-10-01 | |
卷号 | 246页码:12-16 |
关键词 | Superconductor NaFeAs Bond angle Transition temperature |
英文摘要 | The change of superconducting transition temperature (T-c) with bond angle in iron-pnictides was investigated by first-principles calculation based on density functional theory. A Green's function method was adopted to estimate the maximum eigenvalue of Eliashberg equation (an indicator of T-c) for NaFeAs with different bond angles. Through calculations the band structure of NaFeAs was obtained. It was found that hole pockets could form at the center of the first Brillion zone in the band structure, which confirmed the existence of superconductivity in NaFeAs. The upper limit of the Fe-As-Fe bond angle for superconductivity was found to be 121 degrees and the highest T-c would occur at the angle of 108 degrees. (C) 2016 Elsevier Ltd. All rights reserved. |
WOS标题词 | Science & Technology ; Physical Sciences |
类目[WOS] | Physics, Condensed Matter |
研究领域[WOS] | Physics |
关键词[WOS] | STRONG-COUPLED SUPERCONDUCTORS ; THIN-FILMS ; LAYERED SUPERCONDUCTOR ; MGB2 |
收录类别 | SCI |
语种 | 英语 |
WOS记录号 | WOS:000384868100003 |
内容类型 | 期刊论文 |
源URL | [http://ir.sic.ac.cn/handle/331005/22028] |
专题 | 上海硅酸盐研究所_高性能陶瓷和超微结构国家重点实验室_期刊论文 |
作者单位 | 1.Hong Kong Polytech Univ, Dept Appl Phys, Hong Kong, Hong Kong, Peoples R China 2.Chinese Acad Sci, Shanghai Inst Ceram, State Key Lab High Performance Ceram & Superfine, Shanghai, Peoples R China 3.China Acad Engn Phys, Mianyang 621900, Sichuan, Peoples R China |
推荐引用方式 GB/T 7714 | Sun, Tieyu,Huang, Haitao,Peng, Biaolin,et al. Estimate bond angle dependence of superconducting transition temperature in NaFeAs with the first principle methods[J]. SOLID STATE COMMUNICATIONS,2016,246:12-16. |
APA | Sun, Tieyu.,Huang, Haitao.,Peng, Biaolin.,Zheng, Renkui.,Lam, Chi-Hang.,...&Wang, Yu.(2016).Estimate bond angle dependence of superconducting transition temperature in NaFeAs with the first principle methods.SOLID STATE COMMUNICATIONS,246,12-16. |
MLA | Sun, Tieyu,et al."Estimate bond angle dependence of superconducting transition temperature in NaFeAs with the first principle methods".SOLID STATE COMMUNICATIONS 246(2016):12-16. |
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