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Hydrogen desorption from Si(100)(2 × 1)-H induced by potassium adsorption

✍ Scribed by N. Minami; N. Takagi; M. Nishijima; T. Aruga


Book ID
116066594
Publisher
Elsevier Science
Year
1995
Tongue
English
Weight
767 KB
Volume
325
Category
Article
ISSN
0039-6028

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The adsorption of atomic hydrogen on the reconstructed Si ( lOO)-2 x I surface is studied using embedded Si clusters as models of an extended Si surface. Analytic gradients of generalized valence bond (GVB) wavefunctions are used to predict equilibrium structures and harmonic vibrational frequencies