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. 2020 Nov 2;6(11):e05385. doi: 10.1016/j.heliyon.2020.e05385

Table 6.

Errors of molecular dynamics simulated diffusion coefficient and predicted diffusion coefficient by Eq. (10) of methane in water for various temperature and concentration.

Calc.
R2 96.54987
R2adj 93.67477
RMSD 1.096×10–7
Variance 2.885×10–13