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Naji, M. |
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Motta, Antonella |
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Aletan, Dirar |
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Mohamed, Tarek |
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Ertürk, Emre |
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Taccardi, Nicola |
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Kononenko, Denys |
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Petrov, R. H. | Madrid |
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Alshaaer, Mazen | Brussels |
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Bih, L. |
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Casati, R. |
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Muller, Hermance |
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Kočí, Jan | Prague |
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Šuljagić, Marija |
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Kalteremidou, Kalliopi-Artemi | Brussels |
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Azam, Siraj |
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Ospanova, Alyiya |
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Blanpain, Bart |
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Ali, M. A. |
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Popa, V. |
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Rančić, M. |
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Ollier, Nadège |
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Azevedo, Nuno Monteiro |
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Landes, Michael |
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Rignanese, Gian-Marco |
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Belashchenko, Kirill D.
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Topics
Publications (6/6 displayed)
- 2024On the origin of magnetic anisotropy in 4f -free ferromagnets based on the CaCu5 structurecitations
- 2020Ultrafast spin-currents and charge conversion at 3d-5d interfaces probed by time-domain terahertz spectroscopycitations
- 2013Effects of alloying and strain on the magnetic properties of Fe 16 N 2citations
- 2013Effects of alloying and strain on the magnetic properties of Fe 16N2citations
- 2007Tunneling anisotropic magnetoresistance driven by resonant surface states: First-principles calculations on an Fe(001) surfacecitations
- 2007Tunneling anisotropic magnetoresistance driven by resonant surface states: First-principles calculations on an Fe(001) surfacecitations
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article
Effects of alloying and strain on the magnetic properties of Fe 16N2
Abstract
<p>The electronic structure and magnetic properties of pure and doped Fe <sub>16</sub>N<sub>2</sub> systems have been studied in the local-density (LDA) and quasiparticle self-consistent GW approximations. The GW magnetic moment of pure Fe<sub>16</sub>N<sub>2</sub> is somewhat larger compared to LDA but not anomalously large. The effects of doping on magnetic moment and exchange coupling were analyzed using the coherent potential approximation. Our lowest estimate of the Curie temperature in pure Fe<sub>16</sub>N<sub>2</sub> is significantly higher than the measured value, which we mainly attribute to the quality of available samples and the interpretation of experimental results. We found that different Fe sites contribute very differently to the magnetocrystalline anisotropy energy (MAE), which offers a way to increase the MAE by small site-specific doping of Co or Ti for Fe. The MAE also increases under tetragonal strain. </p>