DiffractGPT predicts crystal structures directly from simulated powder XRD patterns, and its accuracy improves when the chemical composition is provided.
Elements of modern X-ray physics; John Wiley & Sons, West Sussex, UK, 2011
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DiffractGPT: Atomic Structure Determination from X-ray Diffraction Patterns using Generative Pre-trained Transformer
DiffractGPT predicts crystal structures directly from simulated powder XRD patterns, and its accuracy improves when the chemical composition is provided.