The material design aims at designing materials via multi-scale simulation
Lightflow is a powerful, lightweight, and distributed workflow orchestration system written in Python.
Material Model Management System - A comprehensive platform for managing datasets, ML models, and workflows for materials science research.
USIF is a next-generation file format designed for storing and exchanging atomic structure data with unprecedented efficiency and flexibility.
OpenCSP is a comprehensive, open-source Python library for crystal structure prediction and optimization. It provides a flexible framework for exploring and discovering new crystal structures.
MatSimPy (Materials Simulation via Python) is a Python package that used for molecular and materials simulation.
a job model under the framework of girder
Welcome to the GitHub home of Material Design, where we host a collection of software tools and libraries aimed at facilitating the design, analysis, and simulation of material-based projects. Our projects range from APIs for cloud platforms to libraries for executing distributed workflows. Below are some of our notable repositories:
A useful tool to calculate the mechanical properties of two-dimensional materials.
Lightflow is a Python 3.8 library and command-line tool for executing workflows, composed of individual tasks, in a distributed fashion. It is based on Celery and provides task dependencies, data exchange, and more.
MatSimPy (Material Simulation via Python) is an open-source Python package for material science.
Feel free to explore our repositories, contribute to our projects, and join us in advancing the frontier of material science and engineering!
