Alicia M. Elliott's repositories
geminio
Geminio - the MOOSE based cluster dynamics code
kokkos
Kokkos C++ Performance Portability Programming Ecosystem: The Programming Model - Parallel Execution and Memory Abstraction
lammps
Public development project of the LAMMPS MD software package
matgl
Graph deep learning library for materials
mfem
Lightweight, general, scalable C++ library for finite element methods
mmsp
The Mesoscale Microstructure Simulation Project
moose
Multiphysics Object Oriented Simulation Environment
TGS-Processing-Scripts
Repository for TGS MATLAB processing scripts
thermochimica
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 necessary for various materials and process models.
Trilinos
Primary repository for the Trilinos Project
xolotl
Spatially dependent cluster dynamics simulator
openmc
OpenMC Monte Carlo Code
pycalphad
CALPHAD tools for designing thermodynamic models, calculating phase diagrams and investigating phase equilibria.
pymatgen
Python Materials Genomics (pymatgen) is a robust materials analysis code that defines classes for structures and molecules with support for many electronic structure codes. It powers the Materials Project.