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Interpretable liquid crystal phase classification via two-by-two ordinal patterns

arXiv 2603.26723 ↗First posted 19 Mar 2026cond-mat.soft cs.LGcited by 0

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Abstract (arXiv)

Liquid crystal textures encode rich structural information, yet mapping these images to mesophase identity remains challenging because visually similar patterns can arise from distinct structures. Here we present a simple, interpretable representation that maps textures to a 75-dimensional frequency vector of two-by-two ordinal patterns, grouped into eleven symmetry-based types to characterize a large-scale dataset spanning seven mesophases. Combined with a simple machine learning classifier, this lightweight representation yields near-perfect phase recognition, including the difficult distinction between smectic A and smectic B mesophases. Our approach generalizes to unseen compounds and accurately distinguishes between phase identity and material origin. Unlike deep learning methods, each ordinal pattern is readily interpretable, and model explanations augmented with network visualizations of pattern interactions reveal the specific types and pairwise dependencies that drive each mesophase decision, providing compact, physically meaningful summaries of texture determinants. These results establish two-by-two ordinal patterns as an interpretable and scalable tool for liquid crystal image analysis, with potential applications to other complex patterned systems in materials science.

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References · 8

  1. 2017A Unified Approach to Interpreting Model Predictionscited by 6,488
  2. 2016XGBoost: A Scalable Tree Boosting Systemcited by 5,120
  3. 2018UMAP: Uniform Manifold Approximation and Projection for Dimension Reductioncited by 2,841
  4. 2018Consistent Individualized Feature Attribution for Tree Ensemblescited by 279
  5. 2020Learning physical properties of liquid crystals with deep convolutional neural networkscited by 6
  6. 2016Discriminating image textures with the multiscale two-dimensional complexity-entropy causality planecited by 5
  7. 2019Estimating physical properties from liquid crystal textures via machine learning and complexity-entropy methodscited by 4
  8. 2022Two new parameters for the ordinal analysis of imagescited by 1

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