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Zone structure and its genesis from the states of sublattices in orthorhombic MgGeN$_2$

Yu.M. Basalaev, P.V. Demushin, E.V. Nikolaeva, A.V. Silinin

Moscow University Physics Bulletin 2011. 66. N 1. P. 39

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Annotation

It is demonstrated that the crystalline structure of MgGeN$_2$ can be reduced to the superposition of “approximated” high-symmetry Bravais sublattices by shifting atoms in a unit cell within the range of 5% of the lattice constant. The superimposed Brillouin zones were plotted for crystal lattices and sublattices. The computational results are presented for the electronic structure of MgGeN$_2$ in terms of the theory of the density function. The influence of “hidden” symmetry in this crystal on zone spectra is described.

Received: 2010 June 23
Approved: 2011 April 13
PACS:
61.50.-f Structure of bulk crystals
Authors
Yu.M. Basalaev, P.V. Demushin, E.V. Nikolaeva, A.V. Silinin
Kemerovo State University, Kemerovo, Russia
Issue 1, 2011

Moscow University Physics Bulletin

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