LLMs often generate seemingly valid answers to flawed or ill-posed inputs. This is not due to missing knowledge: under discriminative prompting, the same models can mostly identify such issues, yet fail to reflect this in standard generative responses. This reveals a fundamental know-act gap between discriminative recognition and generative behavior. Prior work largely characterizes this issue in narrow settings, such as math word problems or question answering, with limited focus on how to integrate these two modes. In this work, we present a comprehensive analysis using FaultyScience, a newly constructed large-scale, cross-disciplinary benchmark of faulty scientific questions. We show that the gap is pervasive and stems from token-level autoregression, which entangles task selection (validate vs. answer) with content generation, preventing discriminative knowledge from being utilized. To address this, we propose DeIllusionLLM, a task-level autoregressive framework that explicitly models this decision. Through self-distillation, the model unifies discriminative judgment and generative reasoning within a single backbone. Empirically, DeIllusionLLM substantially reduces answer-despite-error failures under natural prompting while maintaining general reasoning performance, demonstrating that self-distillation is an effective and scalable solution for bridging the discriminative-generative know-act gap
On a balanced dataset, these metrics (accuracy = 95%, precision = 90%, recall = 85%) cannot all hold simultaneously. At least one is invalid, so any F1 derived is unreliable.
Table 1: Example where GPT4 fails in generative mode without hints but recognize the issues in discriminative mode.
Count
Ratio (%)
Discipline
Physical Science
3014
19.07
Biological Science
2776
17.57
Earth Science
2404
15.21
Mathematics
2129
13.47
Social Science
2070
13.10
Table 2: Statistics of FaultyScience .
Model
P−hintGen
P+hintGen
PDis
Mixtral-8x7B
10.2
27.8
75.2
Llama3.3 70B
14.0
24.5
90.8
Qwen2.5-72B
10.8
40.1
95.0
GPT4
34.9
48.6
88.1
Table 3: Answer to Q1.1 –performance (%) of existing LLMs in recognizing the issues in the questions of FaultyScience under different prompt style.
Figure 1: Overview of the proposed DeIllusionLLM method.
Model
FaultyScience ( P−hintGen )
BBH
GPQA
Mixtral-8x7B
10.2
16.58
30.13
Llama3.3 70B
14.0
17.11
21.88
Qwen2.5-72B
10.8
42.78
34.15
DeIllusionLLM (self-distilled from Qwen)
67.8
41.71
33.93
GPT-4
34.9
69.50
34.20
DeIllusionLLM (distilled from GPT)
42.7
68.98
38.80
Table 4: DeIllusionLLM vs. baseline LLMs in three benchmarks.
Model
Earth
Physics
Social
Math
Bio
Eng.
Chem.
CS
mean
GPT-4
37.6
18.4
56.0
33.6
31.2
58.4
24.0
7.2
33.3
DeIllusionLLM
60.8
19.2
56.8
30.4
46.4
72.0
22.4
8.8
39.6
Table 5: Model performance, under P−hintGen , on different disciplines of FaultyScience .
Figure 2: Mode [D] percentages for each dataset.
Category
FaultyScience ( P−hintGen )
BBH
GPQA
Aligned (mode = response)
[D] + response_D
51.70%
5.35%
0.00%
[G] + response_G
20.80%
60.43%
80.13%
Misaligned (mode = response)
[D] + response_G
2.40%
26.74%
19.87%
[G] + response_D
25.10%
7.48%
0.00%
Table 6: Mode–response alignment distribution across datasets.
A standard recipe for distilling the reasoning ability of large language models (LLMs) is to sample chains of thought from the model, keep those that reach the correct final answer, and fine-tune on the survivors. When sampling fails, a common fix shows the generator the gold answer and asks it to write a chain that reaches that answer. We show that this second step degrades the training data in a way that correctness filtering cannot catch. We run a controlled experiment that fixes the generator, the problem set, and the correctness filter, and varies only whether the chain is generated under answer-conditioning, the gold answer shown with a request to reach it. Training a strong instruction-tuned reasoning model on its own answer-conditioned chains sharply lowers its verifiable-reasoning accuracy. The loss grows with difficulty, reaching as much as about 27 points on the hardest competition problems. The mechanism is legible in the chains themselves, which rationalize backward from the shown answer instead of deriving it, with the early final-answer statement as the measurable symptom. The harm is a property of the data rather than the generator, read off unlabeled generations before any fine-tuning, ordering the penalty across eight thinking models from four families, and transferring across teacher families. A prompt ablation localizes it to the rationalize-toward instruction rather than the answer's bare visibility. The practical takeaway is to generate answer-blind, because no correctness filter can see this damage in the data.
Jungseob Lee, Seungyoon Lee, Suhyune Son +4
1Korea University · 2Zoom Communications · 3Yonsei University
We study self-modeling: an LLM's ability to answer questions about its own behavior. We focus on verifiable behavioral questions, such as whether a prompt edit would change the model's final answer. To measure this capability, we introduce a benchmark that tests diverse types of self-modeling questions. Current models show non-trivial but limited self-modeling skill, and make systematic mistakes on simple counterfactual questions about their own behavior. To improve self-modeling skill, we develop a scalable synthetic-data pipeline that produces self-modeling training data, and show that reinforcement-learning can improve aggregate self-modeling skill across three open-source model families with some transfer to held-out tasks. These gains, however, do not seem to constitute introspection consistently: improved self-modeling may not arise from privileged access to the model's internal decision process.
Siqi Zeng, Andre N. Assis, Rowan Wang
University of Illinois · Constellation · Anthropic
Modeling student misconceptions in a realistic manner is critical for AI in education. In this work, we examine how large language models (LLMs) reason about misconceptions when generating distractor answers for multiple-choice questions (MCQs), a task that requires producing answers that are incorrect, yet plausible. We introduce a taxonomy over reasoning strategies for distractor generation that is grounded in learning-science literature and empirical observation, which we apply to LLM-generated reasoning traces across math and science MCQs. On the math dataset, we find that models follow a misconception-based process with potentially high diagnostic value: they recover the correct solution, articulate student errors, simulate them, and select plausible candidates. On the science dataset, on the other hand, they tend to follow a less robust approach based on semantic similarity to the correct answer. We find the most frequent failure modes to be that the model is unable to generate a correct solution or that it discards plausible distractor candidates when performing selection. Providing the correct solution in the prompt yields a relative improvement of 6.4% in alignment with human-authored distractors, highlighting the critical role of anchoring distractor generation to the correct solution. Together, our findings offer an interpretable view of how LLMs model incorrect student reasoning.
Yanick Zengaffinen, Andreas Opedal, Donya Rooein +3
1ETH Zürich · 2Bocconi University · University of Central Florida