Band-theoretical study of magnetism in Sc/sub 2/CuO/sub 4/

Journal Article · Fri Jan 01 04:00:00 EST 1988 · Phys. Rev. B: Condens. Matter; (United States)

DOI:https://doi.org/10.1103/PhysRevB.37.384· OSTI ID:5741289

Leung, T C; Wang, X W; Harmon, B N

Self-consistent, spin-polarized calculations were performed for Sc/sub 2/CuO/sub 4/. Both ferromagnetic and antiferromagnetic ground states were investigated and found to be unstable. Magnetic form factors were calculated and are discussed in view of experiments on La/sub 2/CuO/sub 4/ and the applicability of band theory.

• Research Organization: Ames LaboratoryU.S. Department of Energy and Department of Physics, Iowa State University, Ames, Iowa 50011
• DOE Contract Number: W-7405-ENG-82
• OSTI ID: 5741289
• Journal Information: Phys. Rev. B: Condens. Matter; (United States), Journal Name: Phys. Rev. B: Condens. Matter; (United States) Vol. 37:1; ISSN PRBMD
• Country of Publication: United States
• Language: English

Related Subjects

36 MATERIALS SCIENCE
360204* -- Ceramics
Cermets
& Refractories-- Physical Properties
ANTIFERROMAGNETISM
BAND THEORY
CHALCOGENIDES
COPPER COMPOUNDS
COPPER OXIDES
ELECTRONIC STRUCTURE
ENERGY LEVELS
FERROMAGNETISM
GROUND STATES
LCAO METHOD
MAGNETIC PROPERTIES
MAGNETISM
ORIENTATION
OXIDES
OXYGEN COMPOUNDS
PHYSICAL PROPERTIES
SCANDIUM COMPOUNDS
SCANDIUM OXIDES
SELF-CONSISTENT FIELD
SPIN ORIENTATION
TRANSITION ELEMENT COMPOUNDS