Schematic of an AI–DFT workflow showing data processing, feature engineering, and model selection integrated with first-principles validation to enable closed-loop materials discovery and design. (IMAGE)

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Schematic of an AI–DFT workflow showing data processing, feature engineering, and model selection integrated with first-principles validation to enable closed-loop materials discovery and design.

Caption

An AI–DFT workflow showing data processing, feature engineering, and model selection integrated with first-principles validation to enable closed-loop materials discovery and design.

Credit

X. Zhu et al., China University of Petroleum (East China) and collaborators

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Credit must be given to the creator.

License

CC BY

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