Organizations: University of Sydney · San Francisco State University · IIT Madras
Abstract
Deep neural networks are widely believed to derive their expressive power from their ability to form \textbf{hierarchical representations}, capturing progressively more abstract and compositional features across layers. In language modeling, \textbf{transformers} have emerged as the dominant architecture, with early layers capturing local syntactic patterns and later layers encoding more complex clause-level dependencies. While this intuition has shaped model design, there remains a lack of rigorous theoretical work demonstrating \textbf{how} deep transformers represent such hierarchical structures. In this work, we analyze the expressiveness of deep transformer models through the formal lens of bounded-depth, non-recursive context-free grammars. For this class of grammars, we explicitly construct transformers with positional attention whose depth grows linearly with grammar depth, while the neuron count scales with the number of derivation-tree shapes and quadratically with the number of production rules. Our theoretical results support the linear representation hypothesis by demonstrating that these architectures possess the structural capacity to encode abstract grammatical states into low-dimensional, linearly separable subspaces within the residual stream.
To quantify the geometric expressivity of transformers, we introduce a tropical geometry framework to characterize their exact spatial partitioning capabilities. By modeling self-attention as a vector-valued tropical rational map, we prove it evaluates exactly to a Power Voronoi Diagram in the zero-temperature limit. Building on this equivalence, we establish a combinatorial rationale for Multi-Head Self-Attention (MHSA): via the Minkowski sum of Newton polytopes, multi-head aggregation expands the polyhedral complexity to O(NH), overcoming the O(N) bottleneck of single heads. Extending this to deep architectures, we derive the first tight asymptotic bounds on the number of linear regions in transformers (Θ(NdmodelL)), demonstrating a combinatorial explosion driven intrinsically by sequence length N, ambient embedding dimension dmodel, and network depth L. Importantly, we guarantee that this idealized polyhedral skeleton is geometrically stable: finite-temperature soft attention preserves these topological partitions via exponentially tight differential approximation bounds.
Multi-layer transformers form the critical component of essentially all large language models (LLMs) in use today. Because of their ubiquity and computational capability, there is a rapidly growing body of work that aims to precisely calibrate the expressive power of transformers as language recognizers by comparing them against standard models of computation studied for decades by the theoretical computer science community. In this endeavor, circuit complexity has by and large emerged as the "correct" branch of computational complexity to analyze the expressive power of transformers; the reason is that parameterizing transformers by the various resources they use, such as attention and precision, leads to direct comparisons with different classes of circuits parameterized by resources such as type of gates, size, and depth. Here, we present an overview of selected results that delineate the expressive power of transformers using concepts and methods from circuit complexity.
The transformer is the most popular neural architecture for language modeling. The cornerstone of the transformer is its global attention mechanism, which lets the model aggregate information from all preceding tokens before generating the next token. One common variant of attention is called local attention, which restricts each token to aggregating information from a bounded window of predecessors, reducing the quadratic cost of global attention to linear. Although this restriction is usually motivated by efficiency, it has also been found to improve model quality, a phenomenon that has so far lacked a satisfactory explanation. We provide a formal account of this phenomenon in terms of recognizer expressivity. It has been shown that fixed-precision transformers with global attention correspond to a fragment of linear temporal logic containing a single past operator. We additionally prove that adding local attention introduces a second temporal operator, strictly enlarging the class of recognizable regular languages. Moreover, global and local attention are expressively complementary: neither subsumes the other, and combining them yields the richest fragment. Experiments on formal language recognition and natural language modeling corroborate the theory, showing that hybrid global--local transformers outperform their global-only counterparts.