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most citedScalable deeper graph neural networks for high-performance materials property prediction

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cond-mat.mtrl-sci2022

DeepXRD, a Deep Learning Model for Predicting of XRD spectrum from Materials Composition

Rongzhi Dong, Yong Zhao, Yuqi Song +6

One of the long-standing problems in materials science is how to predict a material's structure and then its properties given only its composition. Experimental characterization of…