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Highlights include a method for automated algorithm discovery, a Comment on the opportunities in organic redox flow battery research, and a Perspective on computational drug development.
Highlights include a method for automated algorithm discovery, a Comment on the opportunities in organic redox flow battery research, and a Perspective on computational drug development.
A neural network-based method for advancing orbital-free density functional theory (OFDFT) is developed, which reaches DFT accuracy and maintains lower cost complexity.