RT Journal Article T1 A novel machine learning workflow to optimize cooling devices grounded in solid-state physics A1 García Fernández, Julián A1 Etesse, Guéric A1 Seoane Iglesias, Natalia A1 Comesaña Figueroa, Enrique A1 Hirakawa, Kazuhiko A1 García Loureiro, Antonio Jesús A1 Bescond, Marc K1 Machine learning K1 Cooling devices K1 Solid-state physics K1 Optimization AB Cooling devices grounded in solid-state physics are promising candidates for integrated-chip nanocooling applications. These devices are modeled by coupling the quantum non-equilibirum Green’s function for electrons with the heat equation (NEGF+H), which allows to accurately describe the energetic and thermal properties. We propose a novel machine learning (ML) workflow to accelerate the design optimization process of these cooling devices, alleviating the high computational demands of NEGF+H. This methodology, trained with NEGF+H data, obtains the optimum heterostructure designs that provide the best trade-off between the cooling power of the lattice (CP) and the electron temperature (Te). Using a vast search space of 1.18 × 10−5 different device configurations, we obtained a set of optimum devices with prediction relative errors lower than 4 % for CP and 1 % for Te. The ML workflow reduces the computational resources needed, from two days for a single NEGF+H simulation to 10 s to find the optimum designs. PB Nature SN 2045-2322 YR 2024 FD 2024-11-18 LK https://hdl.handle.net/10347/41933 UL https://hdl.handle.net/10347/41933 LA eng NO Fernandez, J. G., Etesse, G., Seoane, N., Comesana, E., Hirakawa, K., Garcia-Loureiro, A., & Bescond, M. (2024). A novel machine learning workflow to optimize cooling devices grounded in solid-state physics. “Scientific Reports”., vol. 14, 28545 https://doi.org/10.1038/s41598-024-80212-9 NO This work was supported by the Spanish MICINN/AEI, Xunta de Galicia, and FEDER Funds under Grant RYC-2017-23312, Grant PID2019-104834GB-I00, Grant PID2022-141623NB-I00, Grant PID2022-142709OB-C21/PID2022-142709OA-C22, Grant ED431F 2020/008, Grant ED431C 2022/16 and GELATO ANR project (ANR-21-CE50-0017). DS Minerva RD 25 abr 2026