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Published in 2024 at "AIP Advances"
DOI: 10.1063/5.0190997
Abstract: We explore new transition metal (TM) compound sub-nanoclusters, TM8X6 (TM = Mn, Fe, Co and X = P, B, As), using density functional theory. Their optimized geometric structures show the same polyhedral structure (tetrahexahedron) independent…
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Keywords:
compound sub;
metal compound;
transition metal;
sub nanoclusters ... See more keywords