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We present the first-principles calculations of the structural, elastic, electronic, and magnetic properties for a new full-Heusler alloy Mn2MgGe. Both L21 and XA structures are considered for both nonmagnetic and ferromagnetic states. The results show that the XA structure in the ferromagnetic state is the energetically most favorable for the full-Heusler alloy, and exhibits ductile behavior, significant...
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