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Testing the spin-bath view of self-attention: A Hamiltonian analysis of GPT-2 Transformer

Published 1 Jul 2025 in cond-mat.mtrl-sci and cs.LG | (2507.00683v1)

Abstract: The recently proposed physics-based framework by Huo and Johnson~\cite{huo2024capturing} models the attention mechanism of LLMs as an interacting two-body spin system, offering a first-principles explanation for phenomena like repetition and bias. Building on this hypothesis, we extract the complete Query-Key weight matrices from a production-grade GPT-2 model and derive the corresponding effective Hamiltonian for every attention head. From these Hamiltonians we obtain analytic \textit{phase boundaries} logit gap criteria that predict which token should dominate the next-token distribution for a given context. A systematic evaluation on 144 heads across 20 factual-recall prompts reveals a strong negative correlation between the theoretical logit gaps and the model's empirical token rankings ($r\approx-0.70$, $p<10{-3}$).Targeted ablations further show that suppressing the heads most aligned with the spin-bath predictions induces the anticipated shifts in output probabilities, confirming a causal link rather than a coincidental association. Taken together, our findings provide the first strong empirical evidence for the spin-bath analogy in a production-grade model. This validation not only furnishes a tractable, physics-inspired lens for interpretability but also provides the groundwork for novel generative models, bridging the gap between theoretical condensed matter physics and AI.

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