Abstract
We have carried out free energy perturbation calculations to determine the relative free energies of solvation in water for methane, ethane, and propane. Experimentally, the relative solvation free energy of methane and ethane is -0.16±0.01 kcal/mol, and the relative solvation free energy of ethane and propane is 0.17±0.04 kcal/mol
Talk to us
Join us for a 30 min session where you can share your feedback and ask us any queries you have
Disclaimer: All third-party content on this website/platform is and will remain the property of their respective owners and is provided on "as is" basis without any warranties, express or implied. Use of third-party content does not indicate any affiliation, sponsorship with or endorsement by them. Any references to third-party content is to identify the corresponding services and shall be considered fair use under The CopyrightLaw.