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First-principles study of the local structure and crystal field of Yb2＋ in sodium and potassium halides
  • ISSN号：1674-1056
  • 期刊名称：《中国物理B：英文版》
  • 时间：0
  • 分类：O614.511[理学—无机化学;理学—化学] TQ050.2[化学工程]
  • 相关基金：Project supported by the National Natural Science Foundation of China （Grant Nos. 11074315, 11074245, 90922022, and 11111120060）, the Russian Foundation for Basic Research （Grant No. 11-02-91152）, and the European Social Fund （Grant No. MTT50）.
关键词： 晶体场参数, 局部结构, 第一原理, 钠离子, 卤化物, 有效哈密顿方法, 结构计算, 钾, sodium and potassium halides, local coordination structure, distortion, crystal-field parameters
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期刊信息
  • 《中国物理B：英文版》
  • 中国科技核心期刊
  • 主管单位:中国科学院
  • 主办单位:中国物理学会和中国科学院物理研究所
  • 主编：欧阳钟灿
  • 地址：北京 中关村 中国科学院物理研究所内
  • 邮编：100080
  • 邮箱：
  • 电话：010-82649026 82649519
  • 国际标准刊号：ISSN：1674-1056
  • 国内统一刊号：ISSN：11-5639/O4
  • 邮发代号:
  • 获奖情况:
  • 国内外数据库收录:
  • 被引量:406