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Published in 2024 at "Molecular Physics"
DOI: 10.1080/00268976.2024.2388301
Abstract: Transition metal zirconium-doped magnesium clusters, Zr2Mgn (nā=ā1ā11), were studied through a collaborative combination of the CALYPSO code and DFT calculations. The results show that the Zr2Mgn clusters have a structural transition from 2D to 3D…
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Keywords:
doped magnesium;
clusters zr2mgn;
magnesium clusters;
zirconium doped ... See more keywords