MENTOR: A Metacognition-Driven Self-Evolution Framework for Uncovering and Mitigating Implicit Domain Risks in LLMs

Large Language Models (LLMs) have achieved remarkable capabilities but remain vulnerable to jailbreak attacks that elicit harmful or unsafe outputs. Existing safety alignment approaches, including Supervised Fine-Tuning (SFT) and Reinforcement Learning from Human Feedback (RLHF), often require substantial attack-specific supervision and computational resources, while remaining susceptible to shallow safety alignment and over-refusal. To address these challenges, we introduce SSRFT(Supervised Safe-Role Fine-Tuning), the first framework that reformulates safety alignment as the internalization of a predefined safe role. SSRFT constructs a Safe-Role Question-Answer (SRQA) dataset from psychometric questions, limited jailbreak prompts, and a safe-role description. Role-consistent responses are synthesized, validated, and expanded into diverse scenarios, enabling models to internalize safety-oriented values and principles rather than explicit refusal patterns. Experiments across multiple Base and Instruct models show that SSRFT achieves more robust and generalizable safety alignment than standard SFT. SSRFT shows substantially greater robustness to prefilling attacks and better generalization to unseen jailbreak domains, while reducing over-refusal on benign queries and preserving the model's general capabilities. These results establish safe-role internalization as an effective alternative to refusal-centric safety alignment. Warning: This paper contains examples of harmful and toxic language.

Red teaming is critical for uncovering vulnerabilities in Large Language Models (LLMs). While automated methods have improved scalability, existing approaches often rely on static heuristics or stochastic search, rendering them brittle against advanced safety alignment. To address this, we introduce Metis, a framework that reformulates jailbreaking as inference-time policy optimization within an adversarial Partially Observable Markov Decision Process (POMDP). Metis employs a self-evolving metacognitive loop to perform causal diagnosis of a target's defense logic and leverages structured feedback as a semantic gradient to refine its policy, offering enhanced interpretability through transparent reasoning traces. Extensive evaluations across 10 diverse models demonstrate that Metis achieves the strongest average Attack Success Rate (ASR) among compared methods at 89.2%, maintaining high efficacy on resilient frontier models (e.g., 76.0% on O1 and 78.0% on GPT-5-chat) where traditional baselines exhibit substantial performance degradation. By replacing redundant exploration with directed optimization, Metis reduces token costs by an average of 8.2x and up to 11.4x. Our analysis reveals that current defenses remain vulnerable to internally-steered, closed-loop reasoning trajectories under the tested settings, highlighting a critical need for next-generation defenses capable of reasoning about safety dynamically during inference.

This work identifies a critical failure mode in frontier large language models (LLMs), which we term Internal Safety Collapse (ISC): under certain task conditions, models enter a state in which they continuously generate harmful content while executing otherwise benign tasks. We introduce TVD (Task, Validator, Data), a framework that triggers ISC through domain tasks where generating harmful content is the only valid completion, and construct ISC-Bench containing 53 scenarios across 8 professional disciplines. Evaluated on JailbreakBench, three representative scenarios yield worst-case safety failure rates averaging 95.3% across four frontier LLMs (including GPT-5.2 and Claude Sonnet 4.5), substantially exceeding standard jailbreak attacks. Frontier models are more vulnerable than earlier LLMs: the very capabilities that enable complex task execution become liabilities when tasks intrinsically involve harmful content. This reveals a growing attack surface: almost every professional domain uses tools that process sensitive data, and each new dual-use tool automatically expands this vulnerability--even without any deliberate attack. Despite substantial alignment efforts, frontier LLMs retain inherently unsafe internal capabilities: alignment reshapes observable outputs but does not eliminate the underlying risk profile. These findings underscore the need for caution when deploying LLMs in high-stakes settings. Source code: https://github.com/wuyoscar/ISC-Bench