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Quantum-mechanical calculations of the difference of structural energies C14 and bcc phases C14 Fe and Mo and formation energy of ferromagnetic C14 Fe2Mo Laves phase

Journal of Physics: Conference Series (2020) 1431(1)
DOI: 10.1088/1742-6596/1431/1/012059
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Abstract

The structural energies of iron and molybdenum in the BCC and C14 Laves phases in the Fe-Mo system, formation enthalpies and bulk elastic moduli are calculated for further use in the calculations of the BCC/BCC+C14Fe2Mo Laves phase boundary at low (room) temperatures.

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APA

Vasilyev, D. A., & Udovsky, A. L. (2020). Quantum-mechanical calculations of the difference of structural energies C14 and bcc phases C14 Fe and Mo and formation energy of ferromagnetic C14 Fe2Mo Laves phase. In Journal of Physics: Conference Series (Vol. 1431). Institute of Physics Publishing. https://doi.org/10.1088/1742-6596/1431/1/012059

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