Active-learning mapping of the Vicsek model phase diagram

Predicting critical phenomena from limited labeled data remains a challenging task in statistical physics. As percolation theory provides a canonical model for phase transitions with well-established critical exponents, it serves as an ideal benchmark for validating new machine learning frameworks. Here, we introduce a label-efficient learning framework based on a Siamese Neural Network (SNN) to identify phase transitions in three-dimensional site and bond percolation models. Using only 22 labeled probability points drawn entirely from non-critical regions, the method locates percolation thresholds with percent-level accuracy and yields estimates of the critical exponent $ν$ consistent with literature values within statistical uncertainty. Analysis of the learned representations clarifies what the network learns: although trained solely on binary similarity labels, the network autonomously converges to a statistic that coincides quantitatively with the normalized largest-cluster size $S_{max}/L^3$ ($r > 0.99$), the finite-size order parameter of percolation. This underlies the framework's most distinctive capability -- a model trained solely on simple cubic lattices identifies the phase transition in face-centered cubic lattices without retraining. The framework thus offers a complementary route to criticality detection in settings where no quantitative order parameter is explicitly defined or labeled data is scarce.

Persistent entropy is a scalar summary of persistence barcodes widely used to detect regime changes, yet there is no account of when a structural change in a barcode must produce a detectable change in entropy. We establish a model-agnostic theorem supplying such conditions. Treating persistence diagrams as random objects indexed by a control parameter, we identify a dispersion-condensation mechanism in the normalized persistence weights and derive an explicit lower bound on the entropy difference between the two regimes, valid with high probability at finite sample size and insensitive to the absolute scale of bar lifetimes. We also give a procedure for verifying the hypotheses on empirical barcodes. Applied to convolutional networks, the criterion shows that the circular organization of learned filters reported by Gabrielsson and Carlsson emerges through a sharp topological phase transition, and locates its onset: within a few hundred iterations on MNIST, but an order of magnitude later on CIFAR-10. The same criterion detects the Kuramoto synchronization and Vicsek order-disorder transitions.

We construct and evaluate group-equivariant neural networks for the prediction of the two-dimensional $Q$-tensor order parameter of nematic liquid crystals from synthetically generated microscopic textures. Seven architectures, equivariant to cyclic groups $C_k$ of order $k$ for $k=4,\,8,\,16,\,32,\,64,\,128,\, 256$, are built using a combination of weight-sharing constraints, equivariant activations and regularization techniques. To do this, we construct rotation-like permutation matrix groups with elements $\varrho_{C_k}(g)$ that act on row-wise vectorized images, thereby approximating a $\frac{2π}{k}$ rotation of the circular subdomain on square images. We show that all seven equivariant models satisfy the $Q$-tensor equivariance constraint to within single-precision floating point accuracy. Comparing against approximate parameter-matched non-equivariant benchmarks, with and without data augmentation, we find that the equivariant models consistently achieve lower errors and generalize more robustly to unseen defect configurations. Performance increases with group order, suggesting that the incorporation of finer rotational symmetry leads to lower errors.