Article ID Journal Published Year Pages File Type
1615211 Journal of Alloys and Compounds 2013 5 Pages PDF
Abstract
► Ab initio study of Ba2LnSbO6 (Ln = Sm, Gd, Dy and Y) have been done for the first time. ► Lattice constants and oxygen internal parameters calculated. ► Bulk modulus and pressure derivative are calculated for the first time. ► Raman and infrared modes are calculated and compared with the experimental values. ► Born effective charges and dielectric constants have been calculated.
Related Topics
Physical Sciences and Engineering Materials Science Metals and Alloys
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