Predicted structures for Ti8C12 and Si8C12 dodecahedron molecules
- 1 January 1992
- journal article
- research article
- Published by Royal Society of Chemistry (RSC) in Journal of the Chemical Society, Chemical Communications
- No. 17,p. 1222-1224
- https://doi.org/10.1039/c39920001222
Abstract
Quantum cluster calculations confirm the high stability of both M8C12 clusters, their equilibrium geometries being distorted dodecahedrons; the charge transfer within the two cluster types and the electronic structures are shown to be markedly different.Keywords
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