stat.MLOct 14, 2026

Convergence Rates of Gaussian Process Thompson Sampling for Efficient Global Optimization

Authors: Haowei Wang, Yilin Zheng

Organizations: National University of Singapore Singapore

Abstract

Efficient global optimization aims to identify a global optimum of an expensive black-box function within a limited evaluation budget NN. We investigate the convergence rates of Gaussian process Thompson sampling (GP-TS) under noiseless observations, assuming a fixed objective function in a reproducing kernel Hilbert space (RKHS). For Matérn kernels with smoothness parameter νν in dimension dd, we establish a worst-case expected simple-regret upper bound of O(N−ν/dlog⁡N)O(N^{-ν/d}\sqrt{\log N}) for both discrete GP-TS on sufficiently fine grids and its continuous counterpart. For the continuous implementation, we develop a nested-grid argument to control posterior sample paths over the entire domain. We further establish matching lower bounds of Ω(N−5/2log⁡N)Ω(N^{-5/2}\sqrt{\log N}) for both implementations under a fixed one-dimensional Matérn-5/25/2 kernel, demonstrating that the logarithmic penalty is intrinsic to standard GP-TS in this setting. Motivated by this limitation, we propose Gaussian Process Capped Thompson Sampling (GP-CTS), which caps posterior sample paths using a valid RKHS norm upper bound while preserving optimism. This modification successfully eliminates the logarithmic penalty and achieves the minimax-optimal rate Θ(N−ν/d)Θ(N^{-ν/d}) for both discrete and continuous implementations.

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