4.2 Article

Finding symmetry breaking order parameters with Euclidean neural networks

Journal

PHYSICAL REVIEW RESEARCH
Volume 3, Issue 1, Pages -

Publisher

AMER PHYSICAL SOC
DOI: 10.1103/PhysRevResearch.3.L012002

Keywords

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Funding

  1. Laboratory Directed Research and Development Program of Lawrence Berkeley National Laboratory under U.S. Department of Energy [DE-AC02-05CH11231]
  2. CAMERA under U.S. Department of Energy [DE-AC02-05CH11231]

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Curie's principle states that there must be symmetry in causes that give rise to asymmetric effects, and symmetry equivariant neural networks uphold this principle, making them useful for articulating symmetry-relevant scientific questions as optimization problems. These properties are proven mathematically and demonstrated numerically through examples such as transforming a square into a rectangle and generating octahedra tilting patterns in perovskites using Euclidean symmetry equivariant neural networks.
Curie's principle states that when effects show certain asymmetry, this asymmetry must be found in the causes that gave rise to them. We demonstrate that symmetry equivariant neural networks uphold Curie's principle and can be used to articulate many symmetry-relevant scientific questions as simple optimization problems. We prove these properties mathematically and demonstrate them numerically by training a Euclidean symmetry equivariant neural network to learn symmetry breaking input to deform a square into a rectangle and to generate octahedra tilting patterns in perovskites.

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