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Updated: Jul 7, 2026

Methods of Ex Situ and In Situ Investigations of Structural Transformations: The Case of Crystallization of Metallic Glasses
Published on: June 7, 2018
Magnetism and local distortions near carbon impurity in gamma-iron
D W Boukhvalov1, Yu N Gornostyrev, M I Katsnelson
1Institute for Molecules and Materials, Radboud University Nijmegen, NL-6525 ED Nijmegen, the Netherlands.
Abstract:
Local perturbations of the crystal and magnetic structure of gamma-iron near carbon interstitial impurity is investigated by ab initio electronic structure calculations. It is shown that the carbon impurity creates locally a region of ferromagnetic ordering with substantial tetragonal distortions. Exchange integrals and solution enthalpy are calculated, the latter being in very good agreement with experimental data. The effect of the local distortions on the carbon-carbon interactions in gamma-iron is discussed.
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