Electronic structure, magnetism and spin-fluctuations in Fe-As based superconductors

  • David J. Singh
  • , Mao Hua Du
  • , Lijun Zhang
  • , Alaska Subedi
  • , Jiming An

Research output: Chapter in Book/Report/Conference proceedingConference contributionpeer-review

Abstract

The physical properties of the layered iron superconductors and related phases are discussed starting from first principles calculations. The electronic structure is described as that of metallic Fe2+ square lattice sheets with substantial direct Fe-Fe hopping and interactions with the neighboring anionic pnictogens or chalcogens. The materials have a semi-metallic band structure, and in particular the Fermi surface consists of small cylindrical electron sections centered at the zone corner, and compensating hole sections at the zone boundary. The density of states N(Ef) is high placing the materials near itinerant magnetism in general, and furthermore the small Fermi surface sections are well nested leading to a tendency towards a spin density wave. Comparison of experimental and density functional results imply the presence of exceptionally strong spin fluctuations in these materials. Superconductivity is discussed within this context.

Original languageEnglish
Title of host publicationSolid-State Chemistry of Inorganic Materials VII
PublisherMaterials Research Society
Pages36-44
Number of pages9
ISBN (Print)9781615677740
DOIs
Publication statusPublished - 1 Jan 2008
Externally publishedYes
Event2008 MRS Fall Meeting - Boston, MA, United States
Duration: 1 Dec 20085 Dec 2008

Publication series

NameMaterials Research Society Symposium Proceedings
Volume1148
ISSN (Print)0272-9172

Conference

Conference2008 MRS Fall Meeting
Country/TerritoryUnited States
CityBoston, MA
Period1/12/085/12/08

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