Abstract

The accuracy of the structural data obtained from the recently proposed generalization tonon-additive hard-spheres (Schmidt 2004 J. Phys.: Condens. Matter 16 L351) ofRosenfeld’s functional is investigated. The radial distribution functions computed from thedirect correlation functions generated by the functional, through the Ornstein–Zernikeequations, are compared with those obtained from the density profile equations in thetest-particle limit, without and with test-particle consistency. The differences between theseroutes and the role of the optimization of the parameters of the reference system when thefunctional is used to obtain the reference bridge functional are discussed in the case ofsymmetric binary mixtures of non-additive hard-spheres. The case of highly asymmetricmixtures is finally briefly discussed.

Full Text
Paper version not known

Talk to us

Join us for a 30 min session where you can share your feedback and ask us any queries you have

Schedule a call

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.