Poster 1 (Zoom)

[PS1-O-02] Experience of using variants of binary correlation functions approximations for calculations of free energy functional of simple liquids

*Evgenii Sergeevich Brikov¹ (1. Individual private researcher (Russia))

Keywords:Gibbs equilibrium statistical mechanics, generating functionals of distributions and correlation functions, quasicrystal model approach of theory of simple liquids in direct variational methods, Gaussian functions which are displaced and averaged in 3-dimensional space (GFDA3D), Hermite functions, tangent transformation of generating functional and reconstruction free energy functional, ordinary and multiplicative correlation functions, hyper-netted chain (HNC) approximation of free energy functional, calculation of multicenter integrals, comparison with results of molecular dynamics method