Machine Learning-Accelerated DFT Optimization of PtPd-based High-Entropy Alloys for Hydrogen Evolution Catalysis

Khajondetchairit, P., Somdee, S., Saelee, T., Ektarawong, A., Alling, B., Praserthdam, P., … & Praserthdam, S. Machine Learning-Accelerated DFT Optimization of PtPd-based High-Entropy Alloys for Hydrogen Evolution Catalysis. International Journal of Minerals, Metallurgy and Materials.   https://dx.doi.org/10.1007/s12613-025-3173-z  (click to read accepted version)

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