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FeOs - Framework for Equations of State's repositories

FeOs - A Framework for Equations of State and Classical Density Functional Theory

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Computer-aided molecular and process design based on the FeOs framework

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Implementation of the PC-SAFT equation of state and corresponding Helmholtz energy functional.

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A collection of notebooks showcasing FeOs

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Some functions of FeOs exposed in a C interface

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Generic classical DFT implementations for the `feos` project.

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Core traits and functionalities for the `feos` project.

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Functionalities for parameter estimation.

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Fused-chain Helmholtz energy functional implemented in the `feos` framework.

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Implementation of the heterosegmented group contribution PC-SAFT equation of state and corresponding Helmholtz energy functional.

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Implementation of the PeTS equation of state and corresponding Helmholtz energy functional.

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Automatic differentiation of phase equilibria

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Implementation of the uv-theory.

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