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Sven Michael Pohl
teqp_fork_old
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b4ea4bd68451b8cb85f730e81a305a8e4afd0734
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Created with Raphaël 2.2.0
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Try again to skip pypy builds
Fix order of initialization of internal arrays
Remove two PC-SAFT functions that are not used
Fix virial coefficients for SAFT models
Missing sympy now
Bump version
Bump version to fix the kmat loading issues
Fix and test kmat for PCSAFT
Fix equation for SW
Additional tests for non-provided kmat
Revert "Prefer to load packages via conda"
Prefer to load packages via conda
Add notes for 0.15.1
Version 0.15.1
Fix rhoV ancillary for n-Hexane, don't test pseudo-pure
Bump version
Fixes to allow PC-SAFT to be evaluated at zero density better
Fix kmat handling in the Python shim functions
Small tweaks to docs after release
Version 0.15.0
Add SAFT-VR-Mie to docs index
Add some more L-J models to docs
Go back to 10 terms in the quadrature
Break up calculation for d into two parts
Generalize the quad function to allow both arguments to be non-double types
Fix kmat error handling for SAFT models
Fix all xi -> zeta in SAFT-VR-Mie
Fix the virial coefficient calcs for SAFT-VR-Mie
Store the script for Mie monomer, can be helpful for testing
Add a method to get the core calcs in Python
Allow for some slop in test
Fix the output types from the core calcs of SAFT-VR-Mie
Merge pull request #37 from usnistgov/SAFTVRMie
SAFT-VR-Mie implementation appears to be working
Test binary tracing
Generalize some pure routines; add pure_trace_VLE method
Fix Thol LJ 12-6 EOS test
Some more tests for SAFT-VR-Mie
REArrayd to EArrayd
Some bugs for mixtures in SAFT-VR-Mie
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