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Predicting solvation free energies in non-polar solvents using classical density functional theory based on the PC-SAFT equation of state

, , , and . The journal of chemical physics, 154 (24): 244106 (2021)
DOI: 10.1063/5.0051201

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Predicting solvation free energies in non-polar solvents using classical density functional theory based on the PC-SAFT equation of state, , , and . The Journal of Chemical Physics, (Jun 28, 2021)Supporting Information: Solute Configurations in n-hexane, cyclohexane and benzene, , , and . Dataset, (2021)Related to: Eller, J., Matzerath, T., van Westen, T., & Gross, J. (2021). Predicting solvation free energies in non-polar solvents using classical density functional theory based on the PC-SAFT equation of state. The Journal of chemical physics, 154(24), 244106. doi: 10.1063/5.0051201.Predicting solvation free energies in non-polar solvents using classical density functional theory based on the PC-SAFT equation of state, , , and . The journal of chemical physics, 154 (24): 244106 (2021)