Data for "Lattice vacancy migration barriers in Fe-Ni alloys, and an indication as to why Ni atoms diffuse slowly: A first-principles study"
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Dataset associated with "Lattice vacancy migration barriers in Fe-Ni alloys, and an indication as to why Ni atoms diffuse slowly: A first-principles study". Version 2 contains additional data relating to calculation of vacancy formation energies (enthalpies).
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Zenodo创建时间：
2025-12-11
