Interpretable self-driving sputtering epitaxy reveals human-usable growth rules for β-Ga2O3 films

Engineering notes

As a benchmark, we apply this framework to sputtering, addressing a challenge in sputtering epitaxy: realizing high-quality β -Ga 2 O 3 heteroepitaxy and single-crystalline β -Ga 2 O 3 homoepitaxy.

Chinese explanation / 中文解读

中文解读待补充：本站会优先为端到端自动驾驶、BEV感知、3D目标检测、轨迹预测、路径规划、LiDAR感知等高价值论文补充中文说明。

Original abstract

Abstract Self-driving laboratories are powerful tools for navigating high-dimensional process spaces, yet Bayesian-optimization decision layers optimize black-box objective functions without distilling transferable process understanding. Here, we demonstrate a mathematically interpretable self-driving laboratory framework that transforms autonomous optimization data into human-executable growth rules. As a benchmark, we apply this framework to sputtering, addressing a challenge in sputtering epitaxy: realizing high-quality β -Ga 2 O 3 heteroepitaxy and single-crystalline β -Ga 2 O 3 homoepitaxy. By combining Bayesian optimization with automated optical evaluation of the Urbach energy as a sub-bandgap disorder metric, the self-driving system identifies heteroepitaxial conditions yielding an Urbach energy of 182 meV, below previously reported values for sputtered β -Ga 2 O 3 films. Importantly, the optimized growth window is transferable across substrates, realizing single-crystalline β -Ga 2 O 3 homoepitaxy, corroborated by scanning transmission electron microscopy. To convert closed-loop data into interpretable growth rules, we train a random forest surrogate and reveal that the growth landscape is described by additive contributions from four growth parameters, with a temperature–oxygen interaction. This structure suggests a human-executable strategy with sequential one-dimensional tuning followed by focused two-dimensional refinement, validated by human-executed re-optimization, yielding a reduced Urbach energy of 163 meV. This establishes an interpretable self-driving workflow that converts autonomous optimization data into validated, human-usable growth rules.

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