Projects

EntropyScaling.jl
JuliaLang
Thermodynamics
Transport Properties

Julia package for modeling transport properties based on entropy scaling, enabling the physical modeling of the viscosity, thermal conductivity, and diffusion coefficients

MLThermoProperties.jl
JuliaLang
Thermodynamics
Machine Learning

Implementation of hybrid ML models for thermodynamic property prediction

Clapeyron.jl
JuliaLang
Thermodynamics

Extensive thermodynamic library written in the Julia language, including thermodynamic property solvers and a large variety of different models

pyclapeyron
Python
Thermodynamics

Python wrapper for Clapeyron.jl

BatchDistillation.jl
JuliaLang
Process Simulation

Julia code to simulate dynamic batch distillation processes using Clapeyron.jl and MLThermoProperties.jl as thermodynamic backends

QMThermoProperties.jl
JuliaLang
Thermodynamics

Small Julia package to calculate thermodynamic properties based on quantum mechanical (QM) calculations from the CHAOS database

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