Python implementation of the multistate Bennett acceptance ratio (MBAR)

High-performance and differentiation-enabled nonlinear solvers (Newton methods), bracketed rootfinding (bisection, Falsi), with sparsity and Newton-Krylov support.

Free boundary Grad-Shafranov solver

provides a modeling interface for mixed complementarity problems (MCP) and math programs with equilibrium problems (MPEC) via JuMP

Modern Fixed Point Systems using Pytorch

Do you work with chemical reactors? Are you curious about them? ASALI is the open-source code that you are looking for. Chemical reactor models, transport/thermodynamic properties of gases, equilibrium calculations. ASALI couples all these features with an user friendly graphical interface. Modeling catalytic reactors has never been so easy.

THERMOCHIMICA is a computational library for chemical thermodynamics. It determines a unique combination of phases and their compositions for a prescribed chemical composition, temperature and pressure. The solver and the underlying thermodynamic models can be used to estimate the chemical state and various constitutive and transport properties …

PorousMediaLab - toolbox for batch and 1D reactive transport modelling

This is a list of my published works. For more details check my Google Scholar profile.

Physical properties calculation using EOS and correlations

Source files of Helbreath v3.82 (client + server) from the Equilibrium Project.

Scripting programming language

methanol+1-octanol VLE

Strategy and equilibria toolkit

A Julia implementation of several tools for solving school-choice problems and computing equilibria in nonatomic school-choice markets.

Computation of dynamic selfish flows using predicted travel times

Computation of complex chemical equilibria of perfect gases and pure condensed species in order to characterize rocket motor performance. This software intends to be a replacement for the highly useful propep while allowing more flexibility. Original author: Antoine Lefebvre

Script to visualize a 2D or 3D truss, calculate stresses and FOS, analyze material costs, then display the stresses and print out the truss's data. Preloaded with model truss balsa wood pieces.

ASALI is an open-source software for solving gas thermodynamic and transport properties, catalytic reactors and chemical equilibrium calculations.