Projekte: Computergestütztes Design von (metall-)organischen Halbleitermaterialien und Photo-Elektrokatalysatoren

Schöttle, Marius ; Tran, Thomas ; Oberhofer, Harald ; Retsch, Markus:
Machine Learning Enabled Image Analysis of Time-Temperature Sensing Colloidal Arrays.
In: Advanced Science. Bd. 10 (2023) Heft 8 . - 2205512.
DOI: https://doi.org/10.1002/advs.202205512

Yao, Yuxuan ; Han, Dan ; Spooner, Kieran B. ; Jia, Xiaoyu ; Ebert, Hubert ; Scanlon, David O. ; Oberhofer, Harald:
Adapting Explainable Machine Learning to Study Mechanical Properties of 2D Hybrid Halide Perovskites.
In: Advanced Functional Materials. Bd. 35 (2025) Heft 1 . - 2411652.
DOI: https://doi.org/10.1002/adfm.202411652

Yao, Yuxuan ; Oberhofer, Harald:
Designing building blocks of covalent organic frameworks through on-the-fly batch-based Bayesian optimization.
In: The Journal of Chemical Physics. Bd. 161 (2024) Heft 7 . - 074102.
DOI: https://doi.org/10.1063/5.0223540