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Formation of Representations in Neural Networks
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Proposes the Canonical Representation Hypothesis (six alignment relations among representations, gradients and weights in fully connected layers), proves it under noise-regularization balance, and derives the Polynomial Alignment Hypothesis for broken-CRH phases, with experiments on ResNet, transformers and MLPs.
Problem
How complex, structured and transferable neural representations form during training, and what universal relations govern hidden-layer representations, weights and neuron gradients.
Approach
Within a fully connected layer, representation second moments, neuron-gradient second moments and weight Gram matrices become mutually aligned after training because SGD gradient noise balances weight decay; when this alignment breaks, the matrices become reciprocally polynomially related (PAH), giving distinct phases.
Key results
- In ResNet-18 on CIFAR-10, alignment alpha > 0.7 is reached early in training and keeps improving in later stages.
- In a six-layer transformer, eigenvalue power-law exponents observed were 3, 2 and 1 for successive layers, within the predicted range [1/3, 3].
- Theory shows NC1-NC4 is equivalent to the CRH for quasi-interpolating classifiers under a loss-covariance-proportional-to-identity assumption.
Measured effects reported in the paper
| What was changed | Where | Measured | Effect |
|---|---|---|---|
| increase weight decay | fully connected networks (fc1) · fc1 synthetic dataset | alignment (α) | Helped |
| decrease batch size and increase weight decay | ResNet-18 self-supervised training · CIFAR-10/100 (res2) | alignment (α) | Helped |
| increase batch size | fully connected networks (fc1) · fc1 synthetic dataset, earlier layers | alignment (α) | Hurt |
| increase batch size | fully connected networks (fc1) · fc1 synthetic dataset, later layers | alignment (α) | Helped |
| increase network width with Adam | fully connected networks (fc1) · fc1 synthetic dataset, early versus later layers | alignment (α) | Mixed |
| normalize activations and gradients and subtract their means | alignment measurement · experiments across settings | alignment (α) | Helped |
| compare representation-gradient alignment against random-projection alignment | six-layer transformer · OWT | alignment (α): 0.14 | Helped |
| use a later fully connected layer rather than a convolutional layer | ResNet-18 self-supervised training · CIFAR-10/100 (res2) | representation-gradient alignment | Helped |
| move to deeper layers | fully connected networks (fc1) · fc1 synthetic dataset | alignment (α) | Helped |
Surprising findings
- Almost all observed positive power-law exponents fall within the predicted range [1/3, 3].
- Representation-gradient alignment holds better in later layers than earlier layers, and the alignment is stronger at larger weight decay.
Limitations
- Results and theory apply only to fully connected layers; extension to other layer types is left open.
- Focuses on the final stage of representation formation rather than full dynamics.
- Alignment is weaker in convolutional layers in self-supervised settings and CRH breaking is not fully characterized.
Experimental setup
Datasets: CIFAR-10 CIFAR-100 OpenWebText synthetic data from two-layer teacher network
Benchmarks: CIFAR-10 CIFAR-100 OpenWebText
Metrics: Pearson-correlation alignment alpha between covariance matri power-law exponent between eigenvalues
Baselines: random projection baseline initial-vs-final feature alignment baseline cross-head alignment baseline
Builds on: neural collapse neural feature ansatz neural tangent kernel feature learning
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