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Releases: ClapeyronThermo/Clapeyron.jl

v0.6.2

17 Jun 10:49
0a2ea21
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v0.6.1

16 Jun 20:59
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Clapeyron v0.6.1

Diff since v0.6.0

Merged pull requests:

Closed issues:

  • Possible issue with bubble and dew point estimation (or SAFT-gamma Mie) (#262)

v0.6.0

10 Jun 07:15
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Clapeyron v0.6.0

Diff since v0.5.11

Merged pull requests:

Closed issues:

  • EoS: (GC)-PPC-SAFT (#20)
  • EOS-CG 2021 (#233)
  • Ask for help with sCPA calculating the molar volume of water (#265)
  • modified LKP and LKP-SJT (#271)

v0.5.11

28 Mar 20:27
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v0.5.11

New Features

  • Support for reference states. A reference state is a point in V-T space where H = H₀ and S = S₀. Setting those have uses in Reaction equilibria and when comparing between different models.In particular, Reference states are stored in a ReferenceState <: ClapeyronParam in the ideal model parameters. The BasicIdeal model is, intentionally, the only ideal model in Clapeyron that does not have this struct and, as a consequence, it is not able to set reference states.
  • Support for superancillaries via EoSSuperancillaries.jl. When the package is loaded, initial saturation points for cubics and PCSAFT are overloaded to use superancillary evaluations instead of the general x0_sat_pure function. in the case of PCSAFT models, it also speeds up the evaluation of crit_pure.
  • New EoS: EOS-CG (2021) (EOS_CG), a reference model for humid gases and CCS mixtures.
  • New EoS: Lee-Kesler-Plöcker (LKP)
  • New EoS: Shomate ideal model (ShomateIdeal)
  • database: PCPSAFT,gcPCSAFT and gcPCPSAFT are updated to use the values of Rehner (2023).
  • new functions: helmholtz_free_energy_res,gibbs_free_energy_res,internal_energy_res, enthalpy_res
  • database: ReidIdeal now uses the poling coefficients by default.
  • database: JobackIdeal has support for more common group fragments used in gcPCSAFT.
  • melting_temperature, sublimation_temperature does not allocate anymore. Note that the function can still allocate if the EoS model itself allocates.

bug fixes

  • Incorrect value for CPA with water (#256)
  • Bug in SAFT-VR-SW (#165)
  • Bug in CP-PC-SAFT

Merged PRs

Full Changelog: v0.5.10...v0.5.11

v0.5.10

12 Jan 20:02
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Clapeyron v0.5.10

Diff since v0.5.9

Merged pull requests:

Closed issues:

  • Move CPA input to use SI values (#242)

v0.5.9

18 Dec 21:33
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Clapeyron v0.5.9

Diff since v0.5.8

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v0.5.8

30 Nov 02:37
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Clapeyron v0.5.8

Diff since v0.5.7

Merged pull requests:

Closed issues:

  • Including Cp parameter along side Tm and ΔHfus for sle_solubility (#222)
  • Data extraction from csv file (#223)
  • UNIFAC ether and aldehyde groups error (#225)
  • Defining a custom alpha (#226)

v0.5.7

24 Oct 20:54
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Clapeyron v0.5.7

Diff since v0.5.6

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v0.5.6

17 Oct 19:22
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Clapeyron v0.5.6

Diff since v0.5.5

v0.5.5

16 Oct 22:34
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Clapeyron v0.5.5

Diff since v0.5.4

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