Magnetism and local distortions near carbon impurity in $γ$-iron

dc.creatorBoukhvalov, D. W.
dc.creatorGornostyrev, Yu. N.
dc.creatorKatsnelson, M. I.
dc.creatorLichtenstein, A. I.
dc.date2007-06-25
dc.date2007-11-01
dc.date.accessioned2026-07-07T10:00:29Z
dc.date.available2026-07-07T10:00:29Z
dc.descriptionLocal perturbations of crystal and magnetic structure of $γ$-iron near carbon interstitial impurity is investigated by {\it 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 a very good agreement with experimental data. Effect of the local distortions on the carbon-carbon interactions in $γ$-iron is discussed.
dc.description4 pages 3 figures. Final version, accepted to Phys.Rev. Lett
dc.identifierhttps://arxiv.org/abs/0706.3695
dc.identifierhttp://arxiv.org/abs/0706.3695
dc.identifierPhys. Rev. Lett. 99, 247205 (2007)
dc.identifierdoi:10.1103/PhysRevLett.99.247205
dc.identifier.urihttp://salesiana.dossiersoluciones.com/handle/123456789/168334
dc.subjectMaterials Science
dc.titleMagnetism and local distortions near carbon impurity in $γ$-iron
dc.typetext

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