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. 2024 Oct 31;146(45):31198–31204. doi: 10.1021/jacs.4c11211

Figure 2.

Figure 2

Dependence of the dispersion interaction energy (EDISP) on the gravitational-like expression M1M2/RCOM-COM, where M1 and M2 are the molecular masses of the molecules/atoms in the dimer and RCOM-COM is the distance between the respective centers of these masses: (a) Using the many-body dispersion (MBD) method (EDISP, MBD (kcal/mol)). (b) Using the D4 dispersion method (EDISP,D4 (kcal/mol)).