Organizations: Chandar Research Lab · Mila – Quebec AI Institute · LAMA-WeST Lab · Polytechnique Montréal · Independent researcher · Université de Montréal
Abstract
Language models are increasingly used in settings where outputs must satisfy user-specified randomness constraints, yet their generation probabilities are often poorly calibrated to those targets. We study whether this capability can be improved directly through fine-tuning. Concretely, we fine-tune language models on synthetic prompts that require sampling from mathematical distributions, and compare two Calibration Fine-Tuning variants: a soft-target method that converts the desired output distribution into trie-derived next-token targets, and a hard-target method that trains on sampled completions from the same target distribution. Across 12 models spanning four families, both methods substantially improve structured-sampling fidelity on held-out distribution families and unseen parameter settings, showing that probabilistic calibration is a trainable capability. Under our selected training configurations, the two methods exhibit different empirical profiles: hard-target fine-tuning is often strongest on structured numeric sampling, while soft-target fine-tuning performs better on broader stochastic generation benchmarks, including open-ended random generation, multiple-choice answer-position balancing, and NoveltyBench. The gains sometimes reduce downstream capability, especially arithmetic reasoning, with costs varying by model. Overall, our results show that probabilistic calibration can be improved through fine-tuning, with our hard-target configuration favoring exact numeric fidelity and our soft-target configuration favoring broader stochastic transfer. Code is available at https://github.com/chandar-lab/calibration-finetuning.
Reasoning language models are increasingly asked not only to answer difficult questions, but also to estimate their likelihood of success. Existing methods typically elicit confidence only once: either before thinking or after answering. We argue that confidence in reasoning models is state-dependent: before thinking, confidence should estimate the chance of the model correctly solving the prompt, while after thinking it should predict whether the realized answer is likely to be correct. This distinction determines the appropriate supervision target: prompt-level success should supervise confidence estimates made after seeing the prompt, while individual answer-level correctness should supervise confidence estimates made after answering. We introduce CALIBER (Calibration Before and After Reasoning), which elicits both estimates and supervises each with the target matched to its information state. Under this unified protocol, CALIBER reduces Expected Calibration Error (ECE) by 52.5% over the strongest single-confidence baseline on BigMathDigits for the 7B model, while achieving the best Brier score and AUROC, and remains within 2.1 points of the best accuracy. Further, on a larger 30B model, CALIBER achieves the best ECE on BigMathDigits while remaining competitive in Brier score and AUROC. Out of distribution, it achieves the best ECE and Brier score on GPQA and TriviaQA, and remains competitive on SimpleQA. Ablations further show that this position-target alignment is most beneficial under distribution shift where it consistently reduces calibration error across all out-of-distribution benchmarks.
Large Language Models remain plagued by hallucinations. Recent work has sought to tame their prevalence using statistical techniques based on conformal prediction, with both theoretical and empirical success. However, these methods operate in a post-hoc fashion, treating the sampling procedure itself as atomic and then surgically altering samples to remove hallucinated claims. This disconnect between filtering and generation can result in samples that are incoherent, inconsistent, or simply unlikely under the model itself. Moreover, post-hoc surgery is unable to shift probability mass towards more useful and helpful responses. To address these issues, we propose to instead sample from approximations to an LLM posterior, where the conditioning event corresponds to a calibrated, high-scoring region. We develop a calibration procedure tailored to the setting of conditional sequential generation that effectively identifies this region and achieves target risk control. Empirically, we apply our method to case studies focused on open-ended biography generation and mathematical problem solving; compared to prior work, we obtain the same statistical guarantees, with higher downstream utility.
Nicolas Emmenegger, Theo X. Olausson, Armando Solar-Lezama +1
Reasoning language models can solve increasingly complex tasks, but struggle to produce the calibrated confidence estimates necessary for reliable deployment. Existing calibration methods usually depend on labels or repeated sampling at inference time, making them impractical in many settings. We introduce a method for unsupervised confidence calibration of reasoning LLMs when only a single generation is available at inference time. Our approach uses offline sampling on unlabeled data to derive a self-consistency-based proxy target, then distills this signal into a lightweight deployment-time confidence predictor. In a broad evaluation across 5 math and question-answering tasks using 9 reasoning models, our method substantially outperforms baselines, including under distribution shift, and improves downstream performance in selective prediction and simulated downstream decision-making.