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Energetics and structure of stoichiometric SnO2 surfaces studied by first-principles calculations

✍ Scribed by J Oviedo; M.J Gillan

Book ID: 117215032
Publisher: Elsevier Science
Year: 2000
Tongue: English
Weight: 598 KB
Volume: 463
Category: Article
ISSN: 0039-6028
DOI: 10.1016/s0039-6028(00)00612-9

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## Abstract The electronic and magnetic properties of SrFeO~2~ with different magnetic configurations have been calculated via the plane‐wave pseudopotential density functional theory method, using the experimental lattice parameters. The results give an antiferromagnetic ground state for SrFeO~2~