Bistable interstitial-carbon–substitutional-carbon pair in silicon
Phys. Rev. B 42, 5765 – Published 15 September, 1990
DOI: https://doi.org/10.1103/PhysRevB.42.5765
Abstract
A bistable interstitial-carbon–substitutional-carbon pair has been identified in electron-irradiated silicon by a combination of several spectroscopic experimental techniques. In the positive and negative charge states, the stable configuration of the defect involves a carbon-silicon ‘‘molecule’’ which occupies a single lattice site (each atom threefold coordinated) next to a substitutional-carbon atom (fourfold coordinated). In the neutral charge state, the defect rearranges its bonds so that both carbon atoms become substitutional (fourfold coordinated) with a twofold-coordinated silicon atom nestled between them. Detailed microscopic models and configurational-coordinate energy surfaces for each of the three charge states have been obtained.