ClapeyronThermo/GCIdentifier.jl

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MIT License
Created almost 2 years ago
Updated 2 months ago

ClapeyronThermo/GCIdentifier.jl

ClapeyronThermo

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tools to perform group contribution (GC) identification, given the SMILES of a compound

Clapeyron.jl

Clapeyron provides a framework for the development and use of fluid-thermodynamic models, including SAFT, cubic, activity, multi-parameter, and COSMO-SAC.

introduction-to-computational-thermodynamics

A short course designed to introduce key concepts in computational thermodynamics to chemical engineers

Langmuir.jl

Single and Multi-component Adsorption Equilibrium.

SPTNRTL.jl

get parameters of the SPT-NRTL model