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Phase Transition and Electronic Structures of All-d-Metal Heusler-Type X(2)MnTi Compounds (X = Pd, Pt, Ag, Au, Cu, and Ni)
In this work, we investigated the phase transition and electronic structures of some newly designed all-d-metal Heusler compounds, X(2)MnTi (X = Pd, Pt, Ag, Au, Cu, and Ni), by means of the first principles. The competition between the XA and L2(1) structures of these materials was studied, and we f...
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| Udgivet i: | Front Chem |
|---|---|
| Main Authors: | , , , , |
| Format: | Artigo |
| Sprog: | Inglês |
| Udgivet: |
Frontiers Media S.A.
2020
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| Fag: | |
| Online adgang: | https://ncbi.nlm.nih.gov/pmc/articles/PMC7759634/ https://ncbi.nlm.nih.gov/pubmed/33363101 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3389/fchem.2020.546947 |
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