Local properties of the electronic structure of cubic SrTiO3, BaTiO3 and PbTiO3 crystals, analysed using Wannier-type atomic functions
Author:
Publisher
Elsevier BV
Subject
Materials Chemistry,Condensed Matter Physics,General Chemistry
Reference17 articles.
1. Local characteristics of crystal electronic structure in the Hartree-Fock method
2. Population analysis of plane-wave electronic structure calculations of bulk materials
3. Wannier-type atomic functions and chemical bonding in crystals
4. Full inclusion of symmetry in constructing Wannier functions: Chemical bonding in MgO and TiO2 crystals
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