Electronic and Magnetic Properties of Co_{3}V_{2}O_{8} Compound

• Authors: A. Jezierski , R. Szymczak , H. Szymczak , J. Kaczkowski
• Languages of publication: EN

Abstracts

EN

The band structures and the magnetic properties of Co_{3}V_{2}O_{8} compound have been calculated by ab initio scalar-relativistic full potential local orbital method within the local spin density approximation. The band calculations were performed for para-, ferro-, and antiferromagnetic Co_{3}V_{2}O_{8} compounds. The main contribution to the density of states at the Fermi energy comes from minority 3d states of cobalt atoms.

Keywords

EN

71.20.-b; 71.15.-m; 71.15.Ap; 71.15.Mb; 71.20.Be

Discipline

• 71.20.-b: Electron density of states and band structure of crystalline solids
• 71.15.Ap: Basis sets (LCAO, plane-wave, APW, etc.) and related methodology (scattering methods, ASA, linearized methods, etc.)
• 71.20.Be: Transition metals and alloys
• 71.15.Mb: Density functional theory, local density approximation, gradient and other corrections
• 71.15.-m: Methods of electronic structure calculations(see also 31.15.-p Calculations and mathematical techniques in atomic and molecular physics; for electronic structure calculations of superconducting materials, see 74.20.Pq)

• Publisher: Institute of Physics, Polish Academy of Sciences
• Journal: Acta Physica Polonica A
• Year: 2009
• Volume: 115
• Issue: 1
• Pages: 238-240

Dates

published

2009-01

Contributors

author

A. Jezierski

• Institute of Molecular Physics, Polish Academy of Sciences, M. Smoluchowskiego 17, 60-179 Poznań, Poland

author

R. Szymczak

• Institute of Physics, Polish Academy of Sciences, al. Lotników 32/46 02-668 Warszawa, Poland

author

H. Szymczak

• Institute of Physics, Polish Academy of Sciences, al. Lotników 32/46 02-668 Warszawa, Poland

author

J. Kaczkowski

• Institute of Molecular Physics, Polish Academy of Sciences, M. Smoluchowskiego 17, 60-179 Poznań, Poland

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Identifiers

DOI

10.12693/APhysPolA.115.238