4.1 Article

Electronic structure of new LiFeAs high-Tc superconductor

期刊

JETP LETTERS
卷 88, 期 8, 页码 543-545

出版社

MAIK NAUKA/INTERPERIODICA/SPRINGER
DOI: 10.1134/S0021364008200150

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资金

  1. Russian Foundation for Basic Research [08-02-00021, 0802- 00712]
  2. Russian Academy of Sciences
  3. Council of the President of the Russian Federation for Support of Young Scientists and Leading Scientific Schools [MK-2242.2007.2, MK3227.2008.2, NSh-1929.2008.2]
  4. Ural Division and Siberian Branch of the Russian Academy of Sciences
  5. Dynasty Foundation
  6. Russian Science Support Foundation
  7. Ural Division, Russian Academy of Sciences

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We present results of ab initio LDA calculations of electronic structure of next generation layered iron-pnictide high-T (c) superconductor LiFeAs (T (c) = 18 K). Obtained electronic structure of LiFeAs very similar to recently studied ReOFeAs (Re = La, Ce, Pr, Nd, Sm) and AFe(2)As(2) (A = Ba, Sr) compounds. Namely close to the Fermi level its electronic properties are also determined mainly by Fe 3d-orbilats of FeAs4 two-dimensional layers. Band dispersions of LiFeAs are very similar to the LaOFeAs and BaFe2As2 systems as well as the shape of the Fe-3d density of states and Fermi surface.

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