Physical Review Letters · 2007 · 58 citations · 18 references
Natural SciencesMaterials EngineeringMaterials ScienceMagnetic MaterialsMetallic MaterialsMetallurgyFerromagnetic MaterialsFerromagnetismMagnetic CharacterizationMagnetic Properties Of SolidsMagnetism In SolidsX-ray CrystallographyAb Initio CalculationsExtended X-ray Absorption Fine StructureLocal StructureMagnetic AlloysMagnetic Circular DichroismMicrospectroscopySynchrotron X-ray SpectroscopyX-ray Absorption Spectroscopy
Synergistic synchrotron x-ray absorption experiments using imaging magnetic microspectroscopy, x-ray magnetic circular dichroism, and ab initio calculations on FeCr alloys reveal that the Cr content strongly influences the ferromagnetic microstructure and the Fe magnetic moments. The Cr local structure resolved by extended x-ray absorption fine structure (EXAFS) is also found to be affected by the alloy's composition. Both EXAFS and ab initio calculations show a change in the Cr local atomic structure above 10 at.% Cr content from the distance contraction of the first two coordination shells around the Cr absorbing atom. These results indicate the strong dependence of magnetic and structural properties of these alloys on Cr concentration.
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Generalized Gradient Approximation Made Simple
John P. Perdew, Kieron Burke, Matthias Ernzerhof · Physical Review Letters · 1996 · 211.5K citations · Full text
Natural Sciences, Chemistry, Physics +16
Giulio Racah · Physical Review · 1942 · 1.6K citations