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@feos-org FeOs - Framework for Equations of State

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    13 repositories

    • feos

      Public
      FeOs - A Framework for Equations of State and Classical Density Functional Theory
      pythonphysicsdensity-functional-theorythermodynamicschemical-engineeringequation-of-statethermodynamic-propertiesthermodynamics-modelsrust
      Rust
      •
      Other
      •23•121•21•4•Updated Oct 30, 2024Oct 30, 2024

    • feos-campd

      Public
      Computer-aided molecular and process design based on the FeOs framework
      Rust
      •
      Apache License 2.0
      •0•4•0•1•Updated Sep 9, 2024Sep 9, 2024

    • feos-c

      Public
      Some functions of FeOs exposed in a C interface
      Rust
      •0•1•0•0•Updated Jul 11, 2024Jul 11, 2024

    • feos-torch

      Public
      Automatic differentiation of phase equilibria
      Python
      •
      Apache License 2.0
      •0•1•0•0•Updated Apr 15, 2024Apr 15, 2024

    • demo-notebooks

      Public
      A collection of notebooks showcasing FeOs
      Jupyter Notebook
      •0•1•0•0•Updated Jul 8, 2023Jul 8, 2023

    • feos-gc-pcsaft

      Public archive
      Implementation of the heterosegmented group contribution PC-SAFT equation of state and corresponding Helmholtz energy functional.
      Rust
      •
      Other
      •0•0•0•0•Updated Sep 14, 2022Sep 14, 2022

    • feos-estimator

      Public archive
      Functionalities for parameter estimation.
      Rust
      •
      Other
      •1•0•0•0•Updated Sep 14, 2022Sep 14, 2022

    • feos-pets

      Public archive
      Implementation of the PeTS equation of state and corresponding Helmholtz energy functional.
      Rust
      •
      Other
      •0•0•0•0•Updated Sep 14, 2022Sep 14, 2022

    • feos-uvtheory

      Public archive
      Implementation of the uv-theory.
      Rust
      •
      Other
      •0•0•0•0•Updated Sep 14, 2022Sep 14, 2022

    • feos-pcsaft

      Public archive
      Implementation of the PC-SAFT equation of state and corresponding Helmholtz energy functional.
      Rust
      •
      Other
      •5•3•0•1•Updated Sep 14, 2022Sep 14, 2022

    • feos-dft

      Public archive
      Generic classical DFT implementations for the `feos` project.
      Rust
      •
      Other
      •3•1•0•1•Updated Jul 28, 2022Jul 28, 2022

    • feos-core

      Public archive
      Core traits and functionalities for the `feos` project.
      Rust
      •
      Other
      •1•0•0•0•Updated Jun 14, 2022Jun 14, 2022

    • feos-fused-chains

      Public
      Fused-chain Helmholtz energy functional implemented in the `feos` framework.
      Rust
      •0•0•0•0•Updated Mar 8, 2022Mar 8, 2022