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ENTITY GFN1-xTB

GFN1-xTB

PulseAugur coverage of GFN1-xTB — every cluster mentioning GFN1-xTB across labs, papers, and developer communities, ranked by signal.

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  1. TOOL · CL_51408 ·

    New MLIP method uses orbital charges for better accuracy

    Researchers have developed a new method for training machine learning interatomic potentials (MLIPs) that significantly improves sample efficiency and accuracy. By incorporating semiempirical orbital charges, the model …