Clapeyron provides a framework for the development and use of fluid-thermodynamic models, including SAFT, cubic, activity, multi-parameter, and COSMO-SAC.
NeqSim is a library for calculation of fluid behavior, phase equilibrium and process simulation
GOMC - GPU Optimized Monte Carlo is a parallel molecular simulation code designed for high-performance simulation of large systems
NeqSim is a library for calculation of fluid behavior, phase equilibrium and process simulation. This project implements the .Net interface to NeqSim.
Program to calculate phase boundaries of multicomponent systems using Equations of State. WIP now suporting PT envelopes and PX envelopes with partial three-phase-behaviour
::A simple phase EQ extractor for gas hydrate researchers::
It is envisaged to eliminate these light constituents by distillation . A study of the operating conditions of the process can be done in pseudo-binary: we assimilate the C7 cut to n-heptane and the light ones to ethane. We wish to construct the diagrams [T-x-y] and [x-y], [h-x-y] of the ethane-n-heptane binary under a fixed pressure of 13.78 bars.
PyThermoFlash is a Python package for performing thermodynamic vle calculations for various fluid systems.
::A tool to find the phase eq temperature at a given pressure with a given ΔT value::
VLE Calculator using Peng-Robinson Equation of State — Python
A modular Python engine for multicomponent thermodynamic modeling (Peng-Robinson EOS & NRTL) and dynamic batch distillation simulation. Features Rachford-Rice VLE flash solvers, bubble-point tracking, enthalpy balances, and industrial validation against Aspen HYSYS with <0.5% relative error.
Phase Equilibrium Calculator
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