English

Transformers Provably Learn to Internalize Chain-of-Thought

Machine Learning 2026-05-28 v1

Abstract

Chain-of-Thought (CoT) prompting substantially improves the sample efficiency of transformers, reducing the complexity of tasks like parity learning from exponential to polynomial in the input length. However, generating explicit reasoning steps at inference is computationally expensive. Implicit Chain-of-Thought (ICoT) has emerged as a promising empirical remedy that trains models to internalize intermediate steps within their hidden states, but its theoretical foundations remain poorly understood. We give the first theoretical analysis of ICoT, proving that an LL-layer transformer trained under our proposed Log-ICoT curriculum learns kk-parity with poly(n)\mathsf{poly}(n) samples and L=log2kL = \log_2 k training stages. This matches the sample efficiency of explicit CoT while eliminating its inference overhead, and extends prior one-layer parity guarantees to multi-layer architectures. Compared to standard ICoT, which removes thinking tokens one at a time, Log-ICoT removes them in geometric chunks, reducing the number of stages from linear in kk to logarithmic. Experiments on multi-layer transformers confirm the theory and visualize how reasoning is progressively absorbed into deeper layers.

Keywords

Cite

@article{arxiv.2605.28600,
  title  = {Transformers Provably Learn to Internalize Chain-of-Thought},
  author = {Yixiao Huang and Hanlin Zhu and Zixuan Wang and Jiantao Jiao and Stuart Russell and Somayeh Sojoudi and Song Mei},
  journal= {arXiv preprint arXiv:2605.28600},
  year   = {2026}
}
R2 v1 2026-07-22T07:37:26.886Z