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pro vyhledávání: '"A. O. Litinsky"'
Autor:
A. O. Litinsky, S. I. Novikov
Publikováno v:
Russian Physics Journal. 55:752-758
A computational scheme based on the density functional theory modified for structures with translation symmetry is used to investigate the electron energy spectrum of hexagonal gallium nitride and its Y x Ga1–x N (Y ≡ B, Al, In) solid solutions.
Publikováno v:
International Journal of Quantum Chemistry. 107:326-329
A model of molecular claster and nonempirical calculation schemes MP2/6-31G*, MP4/6-31G*, and MP2/DZVP2 were applied to study electronic and energy characteristics of the surface centers of different SiO2 modifications in rigid dehydroxidation condit