Renormalization group approach to multiscale simulation of polycrystalline materials using the phase field crystal model

Physics – Condensed Matter – Materials Science

Scientific paper

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New material added with quantitative comparisons of grain boundary energies and demonstrations of computational efficiency

Scientific paper

10.1103/PhysRevE.72.020601

We propose a computationally-efficient approach to multiscale simulation of polycrystalline materials, based on the phase field crystal (PFC) model. The order parameter describing the density profile at the nanoscale is reconstructed from its slowly-varying amplitude and phase, which satisfy rotationally-covariant equations derivable from the renormalization group. We validate the approach using the example of two-dimensional grain nucleation and growth.

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