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• W2040807038 abstract "Based on the projector augmented-wave method, ab initio calculations confirm the ground state is of ferromagnetic bcc Fe and reveal a paramagnetic state for the hcp Fe. Interestingly, the calculations predict that there exist at least three distinct magnetic orderings for the metastable fcc structured Fe—a paramagnetic and low-spin and high-spin ferromagnetic states—within a lattice constant ranging from 0.34 to 0.38 nm, and that, upon increasing the atomic volume of Fe, the magnetic moment is enhanced and can even be greater than that of the equilibrium bcc Fe." @default.
• W2040807038 created "2016-06-24" @default.
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• W2040807038 date "2004-04-20" @default.
• W2040807038 modified "2023-10-10" @default.
• W2040807038 title "Correlation of magnetic moment versus spacing distance of metastable fcc structured iron" @default.
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• W2040807038 doi "https://doi.org/10.1063/1.1738516" @default.
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