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Free energy of solvation (i.e. residual chemical potential) and Henry's law solubility constants were estimated for mono ethylene glycol (MEG), diethylene glycol (DEG) and triethylene glycol (TEG) with water and methane as solvents at both 298 K and 1 atm and at 283 K and 80 atm using molecular dynamics simulations. Three methods of calculating free energies of solvation were compared: free energy...
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