Abstract
For proper applications of the Stoner condition, we describe the assumptions in its underlying theory and their implications that need to be considered in practice. The nature of Stoner exchange parameters is examined based on spin-polarization perturbational orbital theory and a connection has been made in understanding the parameters with both local spin density and Hartree-Fock approximations via a self-interaction-corrected local spin density (SIC-LSD) exchange-correlation functional.
| Original language | English |
|---|---|
| Pages (from-to) | 2172-2176 |
| Number of pages | 5 |
| Journal | Journal of Computational Chemistry |
| Volume | 29 |
| Issue number | 13 |
| DOIs | |
| Publication status | Published - Oct 2008 |
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Keywords
- Density functional theory
- Itinerant electrons
- LSDA+U
- Magnetism
- Perturbation theory
- Spin polarization
- Stoner condition
ASJC Scopus subject areas
- Chemistry(all)
- Safety, Risk, Reliability and Quality
Cite this
Nature of stoner condition for metallic ferromagnetism. / Seo, Dong Kyun; Kim, Sang Hwan.
In: Journal of Computational Chemistry, Vol. 29, No. 13, 10.2008, p. 2172-2176.Research output: Contribution to journal › Article
}
TY - JOUR
T1 - Nature of stoner condition for metallic ferromagnetism
AU - Seo, Dong Kyun
AU - Kim, Sang Hwan
PY - 2008/10
Y1 - 2008/10
N2 - For proper applications of the Stoner condition, we describe the assumptions in its underlying theory and their implications that need to be considered in practice. The nature of Stoner exchange parameters is examined based on spin-polarization perturbational orbital theory and a connection has been made in understanding the parameters with both local spin density and Hartree-Fock approximations via a self-interaction-corrected local spin density (SIC-LSD) exchange-correlation functional.
AB - For proper applications of the Stoner condition, we describe the assumptions in its underlying theory and their implications that need to be considered in practice. The nature of Stoner exchange parameters is examined based on spin-polarization perturbational orbital theory and a connection has been made in understanding the parameters with both local spin density and Hartree-Fock approximations via a self-interaction-corrected local spin density (SIC-LSD) exchange-correlation functional.
KW - Density functional theory
KW - Itinerant electrons
KW - LSDA+U
KW - Magnetism
KW - Perturbation theory
KW - Spin polarization
KW - Stoner condition
UR - http://www.scopus.com/inward/record.url?scp=50149105637&partnerID=8YFLogxK
UR - http://www.scopus.com/inward/citedby.url?scp=50149105637&partnerID=8YFLogxK
U2 - 10.1002/jcc.21046
DO - 10.1002/jcc.21046
M3 - Article
C2 - 18567008
AN - SCOPUS:50149105637
VL - 29
SP - 2172
EP - 2176
JO - Journal of Computational Chemistry
JF - Journal of Computational Chemistry
SN - 0192-8651
IS - 13
ER -