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cond-mat.mtrl-sci2026
Experimental Powder X-ray Diffraction Crystal Structure Determination with RealPXRD-Solver
Qi Li, Mingyu Guo, Rui Jiao +14
Determining crystal structures from experimental powder X-ray diffraction data remains challenging because peak overlap, preferred orientation, and impurity phases obscure atomic a…
cond-mat.mtrl-sci2024
Auto-resolving the atomic structure at van der Waals interfaces using a generative model
Wenqiang Huang, Yuchen Jin, Zhemin Li +12
The high-resolution visualization of atomic structures is significant for understanding the relationship between the microscopic configurations and macroscopic properties of materi…
cond-mat.mtrl-sci2023
Single-image based deep learning for precise atomic defects identification
Kangshu Li, Xiaocang Han, Yanhui Hong +11
Defect engineering has been profoundly employed to confer desirable functionality to materials that pristine lattices inherently lack. Although single atomic-resolution scanning tr…