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Commits on Jul 21, 2023

• included all exports

  g-bauer

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• export Python objects outside of rust

  g-bauer

  committed
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Commits on Jul 17, 2023

• Add option to provide phase description (#174)

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  g-bauer

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Commits on Jul 14, 2023

• Serialization and documentation of binary association records (#171)

  prehner

  committed
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• Implement binary association parameters (#167)

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  prehner

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• Revised handling of ideal gas contribution (#158)

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  prehner

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• Update num-dual dependency to 0.7 (#137)

  prehner

  committed
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• Revive phi in hetero gc PC-SAFT (#157)

  prehner

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• Revised association contribution (#150)

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Commits on Jul 3, 2023

• Support for second order Feynman-Hibbs corrections using the SAFT-VRQ Mie EOS (#160)

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  morteham

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  g-bauer

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• Make constructors in Parameter trait fallible (#161)

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  g-bauer

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  prehner

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Commits on Jan 28, 2023

• Fix association contribution for some association schemes and improve performance (#129)

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  prehner

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Commits on Jan 27, 2023

• Early return if vapor pressure data set is empty (#124)

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  g-bauer

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• Group contribution method for binary interaction parameters (#104)

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  prehner

  authored
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Commits on Jan 26, 2023

• removed enum default args for text_signature (#122)

  g-bauer

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Commits on Jan 24, 2023

• Update pyO3 to 0.18 (#119)

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  g-bauer

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  prehner

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Commits on Jan 20, 2023

• Remove unit generics (#115)

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  g-bauer

  authored
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Commits on Jan 19, 2023

• Some fixes in the documentation (#118)

  prehner

  authored
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• Add uv b3 (#98)

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Commits on Jan 17, 2023

• Add custom PhaseDiagram constructor (#113)

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  prehner

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Commits on Jan 12, 2023

• Minor cleanup of the PC-SAFT implementation (#108)

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  prehner

  authored
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Commits on Dec 13, 2022

• Export DQVariants in feos.pcsaft module, add documentation (#90)

  g-bauer

  authored
  c6a1bf7

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• Enforce the limitations of the homo gc method for PC-SAFT more strictly (#88)

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  prehner

  authored
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• Refine SAFT-VRQ-Mie functional (#84)

  prehner

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• Add `critical_temperature` argument to `VaporPressure` constructor (#86)

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Commits on Dec 4, 2022

• Implementation of SAFT-VRQ Mie EoS (#79)

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  g-bauer

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Commits on Nov 11, 2022

• Rewrite and document core DFT functionality (#60)

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  prehner

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Commits on Oct 18, 2022

• Export EosVariant and FunctionalVariant at the crate root

  prehner

  committed
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• Add Sync + Send to `EquationOfState` trait bounds (#57)

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  prehner

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Commits on Oct 13, 2022

• Release v0.3.0 (#55)

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  prehner

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Commits on Oct 7, 2022

• Hide AssociationRecord in PcSaftRecord::new (#59)

  prehner

  authored
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Commits on Sep 14, 2022

• Add modules for EosVariant and FunctionalVariant (#46)

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  g-bauer

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• Reuse generic hard sphere implementation in PeTS model (#52)

  prehner

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Commits on Sep 13, 2022

• Implement a `DataSet` for binary VLE data (#44)

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  prehner

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Commits on Aug 25, 2022

• Backwards compatibility of `AssociationRecord` and `PcSaftRecord` (#45)

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  prehner

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