Approaching I/O-optimality for Approximate Attention

We revisit the I/O complexity of attention in large language models. Given query-key-value matrices $Q,K,V\in\mathbb{R}^{n\times d}$, and a machine with fast memory size $M$, the goal is to compute the "attention matrix" $A=\text{softmax}(Q K ^{\top}/\sqrt{d}) V$ with the minimal number of data transfers between fast and slow memory. Existing methods in the literature, most notably FlashAttention and its variants, incur an I/O cost that depends quadratically on $n$, while a trivial lower bound only requires $Ω(nd)$ I/O's to read the inputs and write the output. In this work, we present a technique for computing attention where the I/O cost only depends almost-linearly on $n$ in most parameter regimes. This is achieved by developing I/O-efficient algorithms inspired by the recent approximate attention framework of Alman and Song. We also prove corresponding lower bounds in each parameter regime to show that our algorithms are indeed close to I/O-optimal.