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Evolution of energetics and bonding of compact self-interstitial clusters in Si

โœ Scribed by Bongiorno, A; Colombo, L; Cargnoni, F; Gatti, C; Rosati, M


Book ID
125434614
Publisher
EDP Sciences
Year
2000
Tongue
English
Weight
189 KB
Volume
50
Category
Article
ISSN
0295-5075

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Bonding and energetics in small clusters
โœ Joseph J. BelBruno ๐Ÿ“‚ Article ๐Ÿ“… 2003 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 125 KB

## Abstract Density functional theory is used to study the electronic, geometric, and bonding properties of small Ga~n~, As~m~, and Ga~n~As~m~ clusters with up to eight atoms. New ground state structures for many of these clusters are reported. Electronic states, stabilities, and charges are also r