🧩 LAMMPS Molecular Dynamics Simulator

A comprehensive atomistic simulation code used to simulate isolated and sequence of unit mechanisms. Available on GitHub and PyPI.

Language: C++ | License: GPLv2

🌐 GD3

A mesoscale dislocation dynamics/phase-field used to simulate the effects of collective deformation mechanisms on the evolution of micro-mechanical fields in regions of interests such as grain boundaries and triple junctions.

Language: Fortran | License: GPL-3

⏳ SUNDIALS

An open-source software library of time integrators and nonlinear solvers.

Language: Python/TensorFlow | License: BSD 3-Clause

📏 PyTUQ

A python package for uncertainty quantification in computational models, will be used for design of experiments and dimensionality reduction of simulations and experiments.

Language: Python | License: BSD 3-Clause

🧮 libEnsemble

A python package for ensemble-based optimization and design of experiments.

Language: Python/pypi | License: BSD 3-clause