Leveraging trust for joint multi-objective and multi-fidelity optimization

Abstract In the pursuit of efficient optimization of expensive-to-evaluate systems, this paper investigates a novel approach to Bayesian multi-objective and multi-fidelity (MOMF) optimization. Traditional optimization methods, while effective, often encounter prohibitively high costs in multi-dimensional optimizations of one or more objectives. Multi-fidelity approaches offer potential remedies by utilizing multiple, less costly information sources, such as low-resolution approximations in numerical simulations. However, integrating these two strategies presents a significant challenge. We propose the innovative use of a trust metric to facilitate the joint optimization of multiple objectives and data sources. Our methodology introduces a modified multi-objective (MO) optimization policy incorporating the trust gain per evaluation cost as one of the objectives of a Pareto optimization problem. This modification enables simultaneous MOMF optimization, which proves effective in establishing the Pareto set and front at a fraction of the cost. Two specific methods of MOMF optimization are presented and compared: a holistic approach selecting both the input parameters and the fidelity parameter jointly, and a sequential approach for benchmarking. Through benchmarks on synthetic test functions, our novel approach is shown to yield significant cost reductions—up to an order of magnitude compared to pure MO optimization. Furthermore, we find that joint optimization of the trust and objective domains outperforms sequentially addressing them. We validate our findings with the specific use case of optimizing particle-in-cell simulations of laser-plasma acceleration, highlighting the practical potential of our method in the Pareto optimization of highly expensive black-box functions. Implementation of the methods in existing Bayesian optimization frameworks is straightforward, with immediate extensions e.g. to batch optimization possible. Given their ability to handle various continuous or discrete fidelity dimensions, these techniques have wide-ranging applicability in tackling simulation challenges across various scientific computing fields such as plasma physics and fluid dynamics.