pith:DSMTBBDI
The effect of grain boundaries on magnetic exchange interactions in iron
Grain boundaries in iron strongly perturb local magnetic couplings but reduce the Curie temperature only slightly at realistic densities.
arxiv:2604.10489 v2 · 2026-04-12 · cond-mat.mtrl-sci
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Claims
Monte Carlo results show that, despite pronounced local perturbations, realistic GB densities cause only a small reduction in the Curie temperature because bulk-like regions dominate the global magnetic transition.
The three chosen symmetric tilt grain boundaries and the modeled substitutional and interstitial phosphorus configurations are representative of real polycrystalline iron, and the Heisenberg model with parameters extracted from DFT fully captures the finite-temperature magnetic behavior without missing long-range or anisotropy effects.
Grain boundaries in bcc iron induce local antiferromagnetic exchange couplings that phosphorus segregation suppresses, yet realistic grain boundary densities cause only small reductions in Curie temperature as bulk regions dominate.
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| First computed | 2026-06-10T01:10:00.861950Z |
|---|---|
| Builder | pith-number-builder-2026-05-17-v1 |
| Signature | Pith Ed25519
(pith-v1-2026-05) · public key |
| Schema | pith-number/v1.0 |
Canonical hash
1c993084685cd0f59b2a0025a4d81fb1ff0bf7e06dcf5c6df464c7ee50c7145c
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curl -sH 'Accept: application/ld+json' https://pith.science/pith/DSMTBBDILTIPLGZKAAS2JWA7WH \
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Canonical record JSON
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