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The Si (100) surface: Symmetric or asymmetric dimers?

โœ Scribed by R.M. Tromp; R.G. Smeenk; F.W. Saris


Publisher
Elsevier Science
Year
1981
Tongue
English
Weight
283 KB
Volume
39
Category
Article
ISSN
0038-1098

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Structure of dimers at the C(100), Si(10
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We have performed density functional calculations using cluster models of the C(100), Si(100) and Ge(100) surfaces. We find that the ground-state geometry is strongly dependent upon the constraints imposed during geometry optimization and also can be affected significantly by the cluster size in the