Are Arithmetic Heuristic Neurons Form-Invariant? A Mechanistic Analysis of Symbols, Text, and Code in LLMs

Large language models (LLMs) have demonstrated impressive capabilities, yet their internal mechanisms for handling reasoning-intensive tasks remain underexplored. To advance the understanding of model-internal processing mechanisms, we present an investigation of how LLMs perform arithmetic operations by examining internal mechanisms during task execution. Using early decoding, we trace how next-token predictions are constructed across layers. Our experiments reveal that while the models recognize arithmetic tasks early, correct result generation occurs only in the final layers. Notably, models proficient in arithmetic exhibit a clear division of labor between attention and MLP modules, where attention propagates input information and MLP modules aggregate it. This division is absent in less proficient models. Furthermore, successful models appear to process more challenging arithmetic tasks functionally, suggesting reasoning capabilities beyond factual recall.

A central goal of explainable AI is to express large language model (LLM) decision logic symbolically and ground it in internal mechanisms. Existing rule-extraction methods usually learn ungrounded symbolic surrogates, while mechanistic interpretability links behavior to neurons but often requires hand-crafted hypotheses and costly interventions. We introduce MechaRule, a pipeline that grounds rule extraction in LLM circuits by localizing sparse agonist activations whose ablation disrupts rule-related behavior. MechaRule rests on two findings. First, in a fixed baseline/flip regime, sparse agonist effects can exhibit overtopping: a few high-effect activations remain detectable within larger groups, dominate weaker ones, and flip many of the same examples. In such regimes, adaptive group testing with confidence-guided conservative pruning requires O(k log(N/k) + k) interventions over N candidates when k << N are agonists. Second, agonists are localized more reliably on data splits aligned with close-to-faithful rule behavior; spectral splits provide a rule-free fallback, whereas unfaithful splits degrade localization. Empirically, on arithmetic and jailbreaking, MechaRule recalls 97.0% of highest-effect agonists in matched brute-force validations at only 2.14% of exhaustive-ablation cost on average. Ablating the localized agonists eliminates 97.6--100.0% of eligible correct arithmetic answers and jailbreaks, and can correct arithmetic errors or induce jailbreaks by up to 72.8% and 32.5%.

Large Language Models exhibit paradoxical fragility in fundamental arithmetic, implying a disconnect between internal computation and discrete output. By analyzing the residual stream geometry during multi-operand addition, we identify the Iso-Raw-Sum Trajectory (IRST), a geometric structure where representations are anchored by semantic digits and modulated by continuous carry fibers. We propose the Noisy Quantization Model to explain this geometry, framing arithmetic errors as Geometric Slippages caused by internal neural noise pushing a continuous, latent Carry Potential across quantization thresholds. This geometric framework further elucidates Probe Versatility, explaining how lightweight probes can disentangle coexisting latent signals (such as ground truth versus hallucination) from a single activation vector. Finally, we validate these insights through a geometric consistency check method that effectively detects and corrects these quantization failures during inference. Our code is available at https://github.com/RL-MIND/Shape-of-Addition.