MATHEMATICAL MODELING OF POINT DEFECTS IN MATERIALS SCIENCE

DOI10.1142/S0218202513500528zbMath1282.35035MaRDI QIDQ2868590

Eric Cancès, Claude Le Bris

Publication date: 17 December 2013

Published in: Mathematical Models and Methods in Applied Sciences (Search for Journal in Brave)

zbMATH Keywords

periodicity; renormalization; atomistic models; electronic structure models; multiscale science

Mathematics Subject Classification ID

35B27: Homogenization in context of PDEs; PDEs in media with periodic structure

35-02: Research exposition (monographs, survey articles) pertaining to partial differential equations

Related Items

Geometry equilibration of crystalline defects in quantum and atomistic descriptions, Fast tensor method for summation of long‐range potentials on 3D lattices with defects, Homogenization of Schrödinger equations. Extended effective mass theorems for non-crystalline matter, Analysis of boundary conditions for crystal defect atomistic simulations, A Hölder estimate for non-uniform elliptic equations in a random medium, Examples of computational approaches for elliptic, possibly multiscale PDEs with random inputs, Thermodynamic limit of crystal defects with finite temperature tight binding, Locality of interatomic interactions in self-consistent tight binding models, Decay of entropy solutions of a scalar conservation law beyond a stationary ergodic setting, Homogenization of Liouville equations beyond a stationary ergodic setting, Modelling with measures: approximation of a mass-emitting object by a point source, QM/MM Methods for Crystalline Defects. Part 1: Locality of the Tight Binding Model, Point defects in tight binding models for insulators

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