Oleg E. Peil

Andrei V Ruban1
Evgeniya Kabliman1
1Andrei V Ruban
1Evgeniya Kabliman
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Configurational thermodynamics of the Fe-Cr sigma phase is investigated on the basis of an Ising-type configurational Hamiltonian and a single-site mean-field model for the free energy. The parameters of the statistical models are obtained from efficient first-principles calculations using different computational techniques. We demonstrate that the(More)
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