The Materials Project Workshop Curriculum
☆121Mar 1, 2023Updated 3 years ago
Alternatives and similar repositories for workshop
Users that are interested in workshop are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Jupyter notebooks demonstrating the utilization of open-source codes for the study of materials science.☆290Jun 1, 2026Updated last month
- An automatic engine for predicting materials properties.☆172Nov 12, 2023Updated 2 years ago
- Mr. Network is a python reaction-network for molecular systems☆11Jun 22, 2022Updated 4 years ago
- A repo of examples for the matminer (https://github.com/hackingmaterials/matminer) code☆124Jun 7, 2021Updated 5 years ago
- ☆12Feb 28, 2020Updated 6 years ago
- Deploy open-source AI quickly and easily - Special Bonus Offer • AdRunpod Hub is built for open source. One-click deployment and autoscaling endpoints without provisioning your own infrastructure.
- A set of tools used for setup, analysis and post-processing of Density Functional Theory (DFT) calculations performed with the VASP packa…☆17Feb 5, 2018Updated 8 years ago
- quick analysis of vasp calculation☆38Jun 7, 2024Updated 2 years ago
- Public repo for Materials API documentation☆144Aug 20, 2022Updated 3 years ago
- This add-on to pymatgen provides tools for analyzing diffusion in materials.☆141Jun 1, 2026Updated last month
- Data mining for materials science☆606Jul 13, 2026Updated last week
- MODNet: a framework for machine learning materials properties☆112May 2, 2025Updated last year
- Pymatgen-db provides an addon to the Python Materials Genomics (pymatgen) library (https://pypi.python.org/pypi/pymatgen) that allows the…☆52Jul 6, 2026Updated 2 weeks ago
- ☆16Feb 27, 2020Updated 6 years ago
- Crystal Toolkit is a framework for building web apps for materials science and is currently powering the new Materials Project website.☆200Jul 9, 2026Updated last week
- Bare Metal GPUs on DigitalOcean Gradient AI • AdPurpose-built for serious AI teams training foundational models, running large-scale inference, and pushing the boundaries of what's possible.
- atomate is a powerful software for computational materials science and contains pre-built workflows.☆264Jul 18, 2024Updated 2 years ago
- MatTen: Equivariant Graph Neural Nets for Tensorial Properties of Materials☆44May 28, 2026Updated last month
- Python interface for VASP☆99Updated this week
- A Python library for electronic structure pre/post-processing☆215Jan 29, 2026Updated 5 months ago
- ☆25May 7, 2026Updated 2 months ago
- Topological analysis for Li local space, site, pathway in crystal structures☆14Jan 21, 2020Updated 6 years ago
- A collection of command line utilities for manipulating VASP input / outpu☆25Mar 4, 2022Updated 4 years ago
- Pymatgen-based script to collect structural descriptors from many atomic structures.☆13Nov 29, 2025Updated 7 months ago
- Assets for the 2017 Materials Project workshop☆22Nov 27, 2017Updated 8 years ago
- GPU virtual machines on DigitalOcean Gradient AI • AdGet to production fast with high-performance AMD and NVIDIA GPUs you can spin up in seconds. The definition of operational simplicity.
- A collection of python scripts that deal with VASP outpts, e.g. WAVECAR, POTCAR etc.☆289Apr 27, 2026Updated 2 months ago
- Modulated automation of cluster expansion based on atomate2 and Jobflow☆12Jul 14, 2026Updated last week
- Python Materials Genomics (pymatgen) is a robust materials analysis code that defines classes for structures and molecules with support f…☆1,929Updated this week
- pymatgen-analysis-alloys is an add-on package for pymatgen intended to contain useful classes for describing alloy systems and analyzing …☆19Apr 24, 2026Updated 2 months ago
- ⚗️ matador is an aggregator, manipulator and runner of first-principles calculations, written with a bent towards battery 🔋 electrode ma…☆35Feb 1, 2026Updated 5 months ago
- Heavyweight plotting tools for ab initio calculations☆254Apr 9, 2026Updated 3 months ago
- Active learning workflow developed as a part of the upcoming article "Machine Learning Inter-Atomic Potentials Generation Driven by Activ…☆30Oct 14, 2021Updated 4 years ago
- Unsupervised identification and analysis of ion-hopping events in solid state electrolytes.☆17Dec 19, 2025Updated 7 months ago
- Crystal graph convolutional neural networks for predicting material properties.☆883Sep 6, 2021Updated 4 years ago
- Deploy to Railway using AI coding agents - Free Credits Offer • AdUse Claude Code, Codex, OpenCode, and more. Autonomous software development now has the infrastructure to match with Railway.
- ☆19Jan 27, 2020Updated 6 years ago
- A general parser for VASP☆16Jul 14, 2026Updated last week
- MPmorph is a collection of tools to run and analyze ab-initio molecular dynamics (AIMD) calculations run with VASP, and is currently unde…☆75Feb 28, 2024Updated 2 years ago
- Python for Materials Machine Learning, Materials Descriptors, Machine Learning Force Fields, Deep Learning, etc.☆464Updated this week
- Toyota Research Institute X-ray Spectroscopy. Tools for machine learning of XANES.☆12Jan 31, 2022Updated 4 years ago
- DFT post processing tools☆26Jul 24, 2024Updated last year
- Magnetic critical temperature Calculator☆18Apr 2, 2024Updated 2 years ago