Stability hierarchy of the pseudomorphic FeSi2 phases: α, γ, and defected CsCl
- 16 October 1995
- journal article
- conference paper
- Published by AIP Publishing in Applied Physics Letters
- Vol. 67 (16) , 2293-2295
- https://doi.org/10.1063/1.115130
Abstract
We present a total‐energy stability diagram of FeSi2 phases which explains the recent experimental findings of pseudomorphic epitaxy on Si(111), depending on film thickness and growth conditions. In particular, our tight binding calculations point out that the appearance of the fluorite structure (γ) at very low coverages can only be attributed to a binding energy with the silicon substrate sizeably larger than tetragonal (α) and CsCl‐defected phases.Keywords
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