Improving DFT-predicted band gaps by symbolic regression for semiconductor materials discovery

Exemplar Discovery Paper for Doping design. Exemplar discovery paper for Doping design; selected as a highly cited or venue-prominent research article rather than a general review.

Citation: Takahiro Kono, Souta Miyamoto, Taichi Masuda, Katsuaki Tanabe. Improving DFT-predicted band gaps by symbolic regression for semiconductor materials discovery. Computational Materials Science 2026. https://doi.org/10.1016/j.commatsci.2025.114463

Acknowledgement: Curated by MaterialsAtlas Open Resources from OpenAlex, Crossref, and manual landmark-paper review.