Breaking Data Symmetry is Needed For Generalization in Feature Learning Kernels
Authors: Marcel Tomàs Bernal, Neil Rohit Mallinar, Mikhail Belkin
Organizations: CFIS UPC · UC San Diego
Abstract
Grokking occurs when a model achieves high training accuracy but generalization to unseen test points happens long after that. This phenomenon was initially observed on a class of algebraic problems, such as learning modular arithmetic (Power et al., 2022). We study grokking on algebraic tasks in a class of feature learning kernels via the Recursive Feature Machine (RFM) algorithm (Radhakrishnan et al., 2024), which iteratively updates feature matrices through the Average Gradient Outer Product (AGOP) of an estimator in order to learn task-relevant features. Our main experimental finding is that generalization occurs only when a certain symmetry in the training set is broken. Furthermore, we empirically show that RFM generalizes by recovering the underlying invariance group action inherent in the data. We find that the learned feature matrices encode specific elements of the invariance group, explaining the dependence of generalization on symmetry.
Recursive Feature Machines (RFMs) are a class of kernel machines that utilize the Average Gradient Outer Product (AGOP) as a mechanism for feature learning. They have been shown to effectively replicate the learning dynamics and feature representations of Feedforward Neural Networks (FNNs) across various settings. However, despite comparable capacity for feature learning and the similarities in the features they acquire, RFMs exhibit significantly lower performance than neural networks in certain data-corrupted scenarios. In this work, we investigate these limitations in mathematical problems. As a solution, we introduce a remarkably effective transformation applied to the training labels which promotes learning in noisy, complexly represented, and class-imbalanced data. This simple yet powerful adjustment enables RFMs to close the performance gap with FNNs and, in some cases, even surpass them.
Grokking is the delayed generalisation phenomenon where a transformer trained on modular arithmetic abruptly transitions from near-chance to near-perfect validation accuracy. It has been attributed to a Fourier-based algorithmic circuit, but its timing, causal structure, and controllability remain poorly understood. We introduce the Frequency Synchronization Degree (FSD), a normalised, permutation-tested metric for Fourier circuit synchronisation requiring no prior knowledge of the circuit. Across nine modular addition configurations (five primes, three seeds), FSD reaches its post-grokking level 500 to 3000 steps before grokking (mean lead 1722 steps, every configuration positive, sign-test p approx 0.004), and synchronises before a restricted-logit loss baseline in all nine cases, making it the earliest available predictor. We give direct causal evidence that the inter-phase gap is a regularisation phenomenon: forking training at the FSD-ceiling step and varying weight decay lambda produces monotonically earlier grokking, with delta-t proportional to 1/lambda. This law replicates across three primes (R-squared 0.89 to 0.99 on seed-averaged delta-t); per-run R-squared is unstable due to the chaotic transition, so we report error bars rather than single runs. Grokking occurs at a near-constant memorisation norm across lambda, grounding the constant in a threshold mechanism. This is not an artefact of applying a Fourier detector to a Fourier circuit: on the non-abelian group S5, a basis-faithful generalisation of FSD precedes grokking on all six seeds, while the original Fourier FSD does not. Using the FSD ceiling to schedule a weight-decay increase also accelerates grokking over a fixed schedule without destabilising training. An attention-only variant groks with a strong FSD precursor while an MLP-only model never groks.
We study grokking, the onset of generalization long after overfitting, in a classical ridge regression setting. We prove end-to-end grokking results for learning over-parameterized linear regression models using gradient descent with weight decay. Specifically, we prove that the following stages occur: (i) the model overfits the training data early during training; (ii) poor generalization persists long after overfitting has manifested; and (iii) the generalization error eventually becomes arbitrarily small. Moreover, we show, both theoretically and empirically, that grokking can be amplified or eliminated in a principled manner through proper hyperparameter tuning. To the best of our knowledge, these are the first rigorous quantitative bounds on the generalization delay (which we refer to as the "grokking time") in terms of training hyperparameters. Lastly, going beyond the linear setting, we empirically demonstrate that our quantitative bounds also capture the behavior of grokking on non-linear neural networks. Our results suggest that grokking is not an inherent failure mode of deep learning, but rather a consequence of specific training conditions, and thus does not require fundamental changes to the model architecture or learning algorithm to avoid.