Scatter Plot from Scientific Research

Plot showing calculated ECO2 , EH2O and ECO2-H2O , for known molecular clips ID 2/3/4/5 (ref. 61 ) and related hypothetical molecular models (ID 1/5'/6'/7'), together with their optimized structures with one CO2 or H2O molecule adsorbed. The green areas between the gas molecules and fragments represent their interaction regions, as analysed using the independent gradient model based on Hirshfeld partitioning; the isovalue is taken to be 0.002 e A -3 .

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