Confidence Estimation in Language Models

Large language models present challenges for principled uncertainty quantification, in part due to their complexity and the diversity of their outputs. Semantic dispersion, or the variance in the meaning of sampled answers, has been proposed as a useful proxy for model uncertainty, but the associated computational cost prohibits its use in latency-critical applications. We show that sampled semantic distributions can be distilled into lightweight student models which estimate a prompt-conditioned density before the language model generates an answer token. The student model predicts a semantic distribution over possible answers; the entropy of this distribution provides a prompt-level uncertainty signal, and the probability density allows answer-level reliability evaluation. Across experiments on TriviaQA and MMLU, we find our student models perform competitively relative to the teacher's sampled semantic dispersion on a hallucination prediction task, whilst offering additional uncertainty primitives for out-of-domain detection and multiple-choice answer selection. We term this technique Semantic Self-Distillation (SSD), which can serve as a general framework for distilling predictive uncertainty in complex output spaces beyond language.

Large Language Models usually put more emphasis on accuracy and therefore, will guess even when not certain about the prediction, which is especially severe when fine-tuned on small datasets due to the inherent tendency toward miscalibration. In this work, we introduce Bayesian-LoRA, which reformulates the deterministic LoRA update as a probabilistic low-rank representation inspired by Sparse Gaussian Processes. We identify a structural isomorphism between LoRA's factorization and Kronecker-factored SGP posteriors, and show that LoRA emerges as a limiting case when posterior uncertainty collapses. We conduct extensive experiments on various LLM architectures across commonsense reasoning benchmarks. With only approximately 0.42M additional parameters and ${\approx}1.2{\times}$ training cost relative to standard LoRA, Bayesian-LoRA significantly improves calibration across models up to 30B, achieving up to 84% ECE reduction and 76% NLL reduction while maintaining competitive accuracy for both in-distribution and out-of-distribution (OoD) evaluations.

Knowledge probing quantifies how much relational knowledge a language model (LM) has acquired during pre-training. Existing knowledge probes evaluate model capabilities through metrics like prediction accuracy and precision. Such evaluations fail to account for the model's reliability, reflected in the calibration of its confidence scores. In this paper, we establish an empirical framework to evaluate the calibration of relational knowledge in a closed answer-set setting. We cover three modalities of model confidence: (1) intrinsic confidence, (2) paraphrase consistency and (3) linguistic confidence. Our extensive analysis of 21 causal and 8 masked language models reveals that most models, but especially those pre-trained with the masking objective, are overconfident. The best-calibrated scores come from confidence estimates that account for inconsistencies due to statement rephrasing. Moreover, calibration improves when increasing the number of answer options.

Accurately assessing model confidence is essential for deploying large language models (LLMs) in mission-critical factual domains. While retrieval-augmented generation (RAG) is widely adopted to improve grounding, confidence calibration in RAG settings remains poorly understood. We conduct a systematic study across four benchmarks, revealing that LLMs exhibit poor calibration performance especially when noisy contexts are retrieved. Specifically, contradictory or irrelevant evidence tends to exacerbate the model's overconfidence issue. To address this, we propose NOVA Rules (NOise-Aware Verbal Confidence CAlibration Rules) to provide a principled foundation for resolving overconfidence under noise. We further design NOVA, a noise-aware calibration framework that synthesizes supervision from ~2K HotpotQA examples guided by these rules. By performing supervised fine-tuning (SFT) with this data, NOVA equips models with intrinsic noise awareness without relying on stronger teacher models. Empirical results show that NOVA yields substantial gains, improving ECE scores by 10.9% in-domain and 8.0% out-of-domain. By bridging the gap between retrieval noise and verbal calibration, NOVA paves the way for both accurate and epistemically reliable LLMs.

Confidence estimation (CE) indicates how reliable the answers of large language models are and impacts user trust and decision-making. Existing evaluations mainly concern the alignment between confidence and correctness, but ignore the variability of language: confidence estimates should remain consistent under semantically equivalent prompts or answer variations, while changing when answer meaning differs, as this may indicate a change in correctness. Therefore, we introduce a novel evaluation framework based on three complementary properties: robustness to prompt perturbations, stability across semantically equivalent answers, and sensitivity to semantically different answers. We show that these metrics are largely independent from existing CE metrics, and that common CE methods often fail on them: while most methods achieve high robustness and stability, they struggle to distinguish semantically different answers, potentially because they do not effectively leverage generation-side information. Overall, our framework exposes overlooked limitations of current CE evaluations and provides guidance for selecting confidence estimators for real-world applications.

When a model knows when it does not know, many possibilities emerge. The first question is how to enable a model to recognize that it does not know. A promising approach is to use confidence, computed from the model's internal signals, to reflect its ignorance. Prior work in specific domains has shown that calibration can provide reliable confidence estimates. In this work, we propose a simple, effective, and universal training-free method that applies to both vision and language models, performing model calibration, cascading, and data cleaning to better exploit a model's ability to recognize when it does not know. We first highlight two key empirical observations: higher confidence corresponds to higher accuracy within a single model, and models calibrated on the validation set remain calibrated on a held-out test set. These findings empirically establish the reliability and comparability of calibrated confidence. Building on this, we introduce two applications: (1) model cascading with calibrated advantage routing and (2) data cleaning based on model ensemble. Using the routing signal derived from the comparability of calibrated confidences, we cascade large and small models to improve efficiency with almost no compromise in accuracy, and we further cascade two models of comparable scale to achieve performance beyond either model alone. Leveraging multiple experts and their calibrated confidences, we design a simple yet effective data-cleaning method that balances precision and detection rate to identify mislabeled samples in ImageNet and Massive Multitask Language Understanding (MMLU) datasets. Our results demonstrate that enabling models to recognize when they do not know is a practical step toward more efficient, reliable, and trustworthy AI.

Confidence calibration, the alignment of a model's predicted confidence with its actual accuracy, is crucial for the reliable deployment of Large Language Models (LLMs). However, this critical property remains largely under-explored in multilingual contexts. In this work, we conduct the first large-scale, systematic studies of multilingual calibration across six model families and over 100 languages, revealing that non-English languages suffer from systematically worse calibration. To diagnose this, we investigate the model's internal representations and find that the final layer, biased by English-centric training, provides a poor signal for multilingual confidence. In contrast, our layer-wise analysis uncovers a key insight that late-intermediate layers consistently offer a more reliable and better-calibrated signal. Building on this, we introduce a suite of training-free methods, including Language-Aware Confidence Ensemble (LACE), which adaptively selects an optimal ensemble of layers for each specific language. Our study highlights the hidden costs of English-centric alignment and offer a new path toward building more globally equitable and trustworthy LLMs by looking beyond the final layer.

Best-of-n sampling improves the accuracy of large language models (LLMs) and large reasoning models (LRMs) by generating multiple candidate solutions and selecting the one with the highest reward. The key challenge for reasoning tasks is designing a scoring function that can identify correct reasoning chains without access to ground-truth answers. We propose Probabilistic Confidence Selection And Ranking (PiCSAR): a simple, training-free method that scores each candidate generation using the joint log-likelihood of the reasoning and final answer. The joint log-likelihood of the reasoning and final answer naturally decomposes into reasoning confidence and answer confidence. PiCSAR achieves substantial gains across diverse benchmarks (+10.18 on MATH500, +9.81 on AIME2025), outperforming baselines with at least 2x fewer samples in 16 out of 20 comparisons. Our analysis reveals that correct reasoning chains exhibit significantly higher reasoning and answer confidence, justifying the effectiveness of PiCSAR.

Large language models (LLMs) often produce incorrect answers with high confidence, yet the factors associated with such overconfidence remain insufficiently understood. We study this problem through the lens of knowledge popularity. Using entity-centric factual QA derived from Wikidata triplets, we characterize popularity through question entity popularity, answer popularity, and question-answer co-occurrence. We find two consistent patterns. First, hallucinated answers are far from random: compared with ground-truth answers, they tend to be more popular or more frequently associated with the question entity. Second, confidence is strongly tied to the popularity of generated answers: even among incorrect predictions, more popular answers or those with higher question-answer co-occurrence receive higher confidence. Together, these findings suggest that popular but wrong alternatives may contribute to overconfidence. We further show that popularity-related signals can mitigate overconfidence and improve overall confidence estimation. Across six models and three datasets, incorporating knowledge popularity reduces average confidence on incorrect answers from 0.765 to 0.254 and overall ECE from 0.356 to 0.050, while improving Alignment from 77.08% to 83.72%.