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. 2024 May 1;10(5):923–941. doi: 10.1021/acscentsci.3c01629

Figure 2.

Figure 2

Distribution of the number of MOF + adsorbate DFT calculations for the (a) S2EF and (b) IS2RS/IS2RE tasks on a logarithmic scale. The horizontal lines emphasize the size of the dataset.