Phase-field approximation of sharp-interface energies accounting for lattice symmetry

preprint2026arXivOpen access

Abstract

We present a phase-field approximation of sharp-interface energies defined on partitions, designed for modeling grain boundaries in polycrystals. The independent variable takes values in the orthogonal group O(d)\mathrm{O}(d) modulo a lattice point group G\mathcal{G}, reflecting the crystallographic symmetries of the underlying lattice. In the sharp-interface limit, the surface energy exhibits a Read-Shockley-type behavior for small misorientation angles, scaling as θ∣log⁡θ∣θ|\logθ|. The regularized functionals are applicable to grain growth simulation and the reconstruction of grain boundaries from imaging data.

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