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• W2068232693 abstract "The bridge function of hard spheres is accurately calculated from computer simulation data on the pair distribution function via the inverted Ornstein–Zernike equation at reduced densities ρ* ≡ N σ 3 / V ranging from 0.2 to 1.02, i.e. from low densities through densities in a vicinity of the phase transition to crystal to densities of metastable fluid region. The data are used to propose an analytical representation of the bridge function as a function of the interparticle distance and density. They are further used to construct the so-called Duh– Haymet plot. It is demonstrated that a “general closure” to the Ornstein–Zernike equation in the form B ( r ) = f [γ( r )], where γ is the indirect (or series) correlation function, does not match the data. Nor does an extended closure B ( r ) = f [γ( r ),ρ*] even in the simplest case of the one component hard sphere fluid. A relative success of literature closures to the Ornstein–Zernike equation is discussed." @default.
• W2068232693 created "2016-06-24" @default.
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• W2068232693 date "2010-12-19" @default.
• W2068232693 modified "2023-09-24" @default.
• W2068232693 title "An accurate analytical representation of the bridge function of hard spheres and a question of existence of a general closure to the Ornstein–Zernike equation" @default.
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• W2068232693 doi "https://doi.org/10.1135/cccc2010127" @default.
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