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Direct recognition of crystal structures via three-dimensional convolutional neural networks with high accuracy and tolerance to random displacements and missing atoms

Ziyuan Rao, Yue Li, Hongbin Zhang, Timoteo Colnaghi, Andreas Marek, Markus Rampp, Baptiste Gault

2023Scripta Materialia13 citationsDOI

Topics & Concepts

Convolutional neural networkArtificial intelligenceSegmentationIdentification (biology)Computer scienceCrystal structureMaterials scienceAtom (system on chip)Transformation (genetics)Artificial neural networkMachine learningPattern recognition (psychology)Crystal (programming language)AlgorithmRandom forestCrystallographyChemistryProgramming languageGeneEmbedded systemBotanyBiologyBiochemistryAdvanced Materials Characterization TechniquesX-ray Diffraction in CrystallographyAdvanced materials and composites
Direct recognition of crystal structures via three-dimensional convolutional neural networks with high accuracy and tolerance to random displacements and missing atoms | Litcius