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Fizika Tverdogo Tela, 2016 Volume 58, Issue 2, Pages 392–400 (Mi ftt10095)

This article is cited in 4 papers

Graphenes

Contribution of $\pi$-bonds to effective charges, cohesive energy, and force constants of graphene-like compounds

S. Yu. Davydov

Ioffe Institute, St. Petersburg

Abstract: For 14 two-dimensional hexagonal compounds IV–IV and III–V, analytical expressions have been obtained using the Harrison bond-orbital method for the contribution from the $\pi$-interaction to the polarity of interatomic bonds, the effective atomic and transverse dynamical charges and their dependences on the deformation, as well as to the binding energy, the cohesive energy, and the central and non-central force constants.

Keywords: ZnSe, Cohesive Energy, Flat Structure, Matrix Element Versus, Bulk Compound.

Received: 26.05.2015
Revised: 29.06.2015


 English version:
Physics of the Solid State, 2016, 58:2, 402–412

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© Steklov Math. Inst. of RAS, 2024