Acta Chimica Sinica ›› 2004, Vol. 62 ›› Issue (8): 789-793. Previous Articles     Next Articles

高温超导体中Fe占位研究的一种半经验方法

高发明1, 张思远2   

  1. 1. 燕山大学环境与化学工程系, 秦皇岛, 066004;
    2. 中国科学院长春应用化学研究所, 稀土化学与物理重点实验室, 长春, 130022
  • 投稿日期:2003-10-09 修回日期:2003-12-18 发布日期:2014-02-18
  • 通讯作者: 高发明,E-mail:fmgao@ysu.edu.cn E-mail:fmgao@ysu.edu.cn
  • 基金资助:
    燕山大学博士基金(No.B200387)资助项目.

Semi-empirical Method of Studying Fe Site in High Tc Superconductors

GAO Fa-Ming1, ZHANG Si-Yuan2   

  1. 1. Department of Chemical Engineering, Yanshan University, Qinhuangdao 066004;
    2. Laboratory of Rare Earth Chemistry and Physics, Changchun Institute of Applied Chemistry, Chinese Academy of Sciences, Changchun 130022
  • Received:2003-10-09 Revised:2003-12-18 Published:2014-02-18

Using a semi-empirical theory, the chemical bond properties of Y-124 superconductor were calculated. The relationship between Mössbauer isomer shift and bond properties of Y-124 was elucidated. It was elucidated that the doped Fe3+ ion was located in square planar Cu(1)3+ site of Y-124. The results indicated that we could predict the properties of superconductors from chemical bond viewpoint.

Key words: superconductor, chemical bond, Mössbauer spectroscopy