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arxiv: cond-mat/0304449 · v1 · submitted 2003-04-20 · ❄️ cond-mat

Generating functionals, consistency, and uniqueness in the integral equation theory of liquids

classification ❄️ cond-mat
keywords consistencyequationfunctionalsgeneratingintegralliquidstheoryuniqueness
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We discuss and illustrate through numerical examples the relations between generating functionals, thermodynamic consistency (in particular the virial-free energy one), and uniqueness of the solution, in the integral equation theory of liquids. We propose a new approach for deriving closures automatically satisfying such characteristics. Results from a first exploration of this program are presented and discussed.

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