Combining multi-fidelity modelling and asynchronous batch Bayesian Optimization

被引:13
|
作者
Folch, Jose Pablo [1 ]
Lee, Robert M. [2 ]
Shafei, Behrang [2 ]
Walz, David [2 ]
Tsay, Calvin [1 ]
van der Wilk, Mark [1 ]
Misener, Ruth [1 ]
机构
[1] Imperial Coll London, London, England
[2] BASF SE, Ludwigshafen, Germany
基金
英国工程与自然科学研究理事会;
关键词
Bayesian Optimization; Machine learning; Batch optimization; Asynchronous; Multi-fidelity; GLOBAL OPTIMIZATION; DESIGN; BATTERIES; LOOP;
D O I
10.1016/j.compchemeng.2023.108194
中图分类号
TP39 [计算机的应用];
学科分类号
081203 ; 0835 ;
摘要
Bayesian Optimization is a useful tool for experiment design. Unfortunately, the classical, sequential setting of Bayesian Optimization does not translate well into laboratory experiments, for instance battery design, where measurements may come from different sources and their evaluations may require significant waiting times. Multi-fidelity Bayesian Optimization addresses the setting with measurements from different sources. Asynchronous batch Bayesian Optimization provides a framework to select new experiments before the results of the prior experiments are revealed. This paper proposes an algorithm combining multi-fidelity and asynchronous batch methods. We empirically study the algorithm behaviour, and show it can outperform single-fidelity batch methods and multi-fidelity sequential methods. As an application, we consider designing electrode materials for optimal performance in pouch cells using experiments with coin cells to approximate battery performance.
引用
收藏
页数:16
相关论文
共 50 条
  • [21] A multi-fidelity Bayesian optimization approach based on the expected further improvement
    Shu, Leshi
    Jiang, Ping
    Wang, Yan
    STRUCTURAL AND MULTIDISCIPLINARY OPTIMIZATION, 2021, 63 (04) : 1709 - 1719
  • [22] Fast Benchmarking of Asynchronous Multi-Fidelity Optimization on Zero-Cost Benchmarks
    Watanabe, Shuhei
    Mallik, Neeratyoy
    Bergman, Edward
    Hutter, Frank
    INTERNATIONAL CONFERENCE ON AUTOMATED MACHINE LEARNING, 2024, 256
  • [23] Multi-objective and multi-fidelity Bayesian optimization of laser-plasma acceleration
    Irshad, F.
    Karsch, S.
    Doepp, A.
    PHYSICAL REVIEW APPLIED, 2023, 19 (01):
  • [24] Multi-fidelity Simulation Modelling in Optimization of a Hybrid Submarine Propulsion System
    Molina-Cristobal, Arturo
    Palmer, Patrick R.
    Parks, Geoffrey T.
    PROCEEDINGS OF THE 2011-14TH EUROPEAN CONFERENCE ON POWER ELECTRONICS AND APPLICATIONS (EPE 2011), 2011,
  • [25] Multi-fidelity Bayesian Optimisation with Continuous Approximations
    Kandasamy, Kirthevasan
    Dasarathy, Gautam
    Schneider, Jeff
    Poczos, Barnabas
    INTERNATIONAL CONFERENCE ON MACHINE LEARNING, VOL 70, 2017, 70
  • [26] Falsification of Learning-Based Controllers through Multi-Fidelity Bayesian Optimization
    Shahrooei, Zahra
    Kochenderfer, Mykel J.
    Baheri, Ali
    2023 EUROPEAN CONTROL CONFERENCE, ECC, 2023,
  • [27] Multi-fidelity Bayesian optimization of covalent organic frameworks for xenon/krypton separations
    Gantzler, Nickolas
    Deshwal, Aryan
    Doppa, Janardhan Rao
    Simon, Cory M.
    DIGITAL DISCOVERY, 2023, 2 (06): : 1937 - 1956
  • [28] EFFICIENT MULTI-FIDELITY SIMULATION OPTIMIZATION
    Xu, Jie
    Zhang, Si
    Huang, Edward
    Chen, Chun-Hung
    Lee, Loo Hay
    Celik, Nurcin
    PROCEEDINGS OF THE 2014 WINTER SIMULATION CONFERENCE (WSC), 2014, : 3940 - 3951
  • [29] Towards Efficient Multiobjective Hyperparameter Optimization: A Multiobjective Multi-fidelity Bayesian Optimization and Hyperband Algorithm
    Chen, Zefeng
    Zhou, Yuren
    Huang, Zhengxin
    Xia, Xiaoyun
    PARALLEL PROBLEM SOLVING FROM NATURE - PPSN XVII, PPSN 2022, PT I, 2022, 13398 : 160 - 174
  • [30] Parallel multi-objective Bayesian optimization approaches based on multi-fidelity surrogate modeling
    Lin, Quan
    Hu, Jiexiang
    Zhou, Qi
    AEROSPACE SCIENCE AND TECHNOLOGY, 2023, 143