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By focusing on solid-state electrolytes for battery applications, our discovery pipeline further identified 18 promising candidates with new compositions and rediscovered a decade's worth of collective knowledge in the field as a byproduct. Here we demonstrate how this vision became reality by first combining state-of-the-art artificial intelligence (AI) models and traditional physics-based models on cloud high-performance computing (HPC) resources to quickly navigate through more than 32 million candidates and predict around half a million potentially stable materials. Furthermore, examples of large-scale computational discovery carried through experimental validation remain scarce, especially for materials with product applicability.

Despite a surge in interest and activity, the constraints imposed by large-scale computational resources present a significant bottleneck.

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