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Ab-initio Study of Gallium Arsenide Nanowires

โœ Scribed by Singh, Satyendra; Srivastava, Pankaj; Mishra, Abhay

Book ID
111987065
Publisher
American Scientific Publishers
Year
2009
Tongue
English
Weight
142 KB
Volume
6
Category
Article
ISSN
1546-1955

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Ab initio calculations have been performed on gallium phosphate clusters: Ga(OH);, P(OH):, (HO),GaOP(OH), and Ga,P,O,(OH)s. The influences of the basis set and the level of theory on predicted configurations of the clusters are discussed. Calculated IR spectra have been analyzed and compared with e