Absence of Magnetic Ordering in NiGa2S4

Abstract

Triangular-layered NiGa2S4, contrary to intuitive expectation, does not form a noncollinear antiferromagnetic structure, as do isoelectronic NaCrO2 and LiCrO2. Instead, the local magnetic moments remain disordered down to the lowest measured temperature. To get more insight into this phenomenon, we have performed first principles calculations of the first, second end third neighbors exchange interactions, and found that the second neighbor exchange is negligible, while the first and the third neighbor exchanges are comparable and antiferromagnetic. Both are rapidly suppressed by the on-site Hubbard repulsion.

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Document Details

Document Type
Technical Report
Publication Date
Jun 22, 2010
Accession Number
ADA525389

Entities

People

  • I. I. Mazin

Organizations

  • United States Naval Research Laboratory

Tags

Communities of Interest

  • Energy and Power Technologies

DTIC Thesaurus Topics

  • Abstracts
  • Accuracy
  • Anisotropy
  • Band Structures
  • Couplings
  • Energy Bands
  • First Principles Calculations
  • Ground State
  • Information Operations
  • Magnetic Anisotropy
  • Magnetic Fields
  • Magnetic Moments
  • Metal Oxides
  • Metals
  • Oxides
  • Plane Waves
  • Transition Metals

Fields of Study

  • Physics

Readers

  • Quantum spin resonance or Electron Paramagnetic Resonance spectroscopy.
  • Theoretical Analysis.