7-days of FREE Audio papers, translation & more with Prime
7-days of FREE Prime access
7-days of FREE Audio papers, translation & more with Prime
7-days of FREE Prime access
https://doi.org/10.1080/00268978300102141
Copy DOIJournal: Molecular Physics | Publication Date: Sep 1, 1983 |
Citations: 18 |
It is shown how simple ion-water potentials may be derived from a small number of calculations of energy derivatives without recourse to multiparameter fitting. The method is tested against the SCF data for Li+/H2O, Na+/H2O and K+/H2O due to Kistenmacher, Popkie and Clementi [1, 2], and also against the more extensive Na+/H2O data of Dacre [3, 4]. New four-centre potentials are proposed for Li+/H2O, Na+/H2O and K+/H2O.
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.