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First principles studies of elastic, electronic and optical properties of chalcopyrite semiconductor ZnSnP2

โœ Scribed by S. Sahin; Y.O. Ciftci; K. Colakoglu; N. Korozlu


Book ID
116609212
Publisher
Elsevier Science
Year
2012
Tongue
English
Weight
922 KB
Volume
529
Category
Article
ISSN
0925-8388

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The structural parameters, elastic, electronic, and optical properties of hexagonal BiAlO 3 were investigated by the density functional theory. The calculated structural parameters are in good agreement with previous calculation and experimental data. The structural stability of BiAlO 3 has been con