Published June 29, 2023 | Version 2.0.0
Dataset Open

Dataset for Quantitative description of metal center organization in single-atom catalysts

Description

Dataset for Quantitative description of metal center organization in single-atom catalysts by by K. Rossi, A. Ruiz-Ferrando, D. Faust Akl, V. Gimenez Abalos, J. Heras-Domingo, R. Graux, X. Hai, J. Lu, D. Garcia-Gasulla, N. López, J. Pérez-Ramírez, and S. Mitchell.

The data is structured as follows:

  • 01_Micrographs: all micrographs employed in .tif and .png format. An imageJ macro to overlay coordinate files with images is  attached.
  • 02_Ground_truth: contains the manually-labeled and predicted xy-coordinates of atomic positions including probabilities.
  • 03_All_detection_data: contains all automated predictions of atomic positions in the images of this study (uhd), and of Mitchell et. al in JACS, 144, 8018-8029 (2022) (jacs_train, jacs_test). This folder further contains model weights and area segmentations needed to estimate the surface atomic densities.
  • 04_Trimetallic_analysis: Figures complementing Supplementary Figure S21.

    

Files

Quantitative_description_dataset.zip

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Additional details

Funding

NCCR Catalysis (phase I) 51NF40_180544
Swiss National Science Foundation