nomad-coe / nomad
NOMAD lets you manage and share your materials science data in a way that makes it truly useful to you, your group, and the community.
☆83Updated this week
Alternatives and similar repositories for nomad:
Users that are interested in nomad are comparing it to the libraries listed below
- Specification of a common REST API for access to materials databases☆84Updated this week
- datalab is a place to store experimental data and the connections between them.☆53Updated this week
- A NOMAD plugin containing base sections for measurements.☆14Updated this week
- BET Surface Identification - a program that fully implements the rouquerol criteria☆20Updated last year
- The ELN custom schemas from synthesis experiments☆11Updated last month
- Automated curve data extraction tool☆11Updated last year
- A universal file format for gas adsorption experiments☆14Updated 7 months ago
- WhereWulff: A semi-autonomous workflow for systematic catalyst surface reactivity under reaction conditions☆31Updated 10 months ago
- The Element Movers Distance for chemical composition similarity☆33Updated 4 months ago
- Automatic generation of crystal structure descriptions.☆110Updated 2 months ago
- ☆66Updated last year
- Python package to interact with high-dimensional representations of the chemical elements☆40Updated last week
- Package to perform automatic bonding analysis with the program Lobster in the field of computational materials science and quantum chemis…☆84Updated this week
- A python library for calculating materials properties from the PES☆69Updated this week
- Application of Large Language Models (LLM) for computational materials science - visit jan-janssen.com/LangSim☆56Updated 4 months ago
- Solid-state synthesis science analyzer. Thermo, features, ML, and more.☆24Updated 2 years ago
- A Python package for estimating diffusion properties from molecular dynamics simulations.☆63Updated last week
- A Pymatgen IO module for setting up OpenMM simulations.☆11Updated 11 months ago
- This repo contains data files and code used for tutorial MD00 at the MRS spring meeting 2023.☆12Updated 8 months ago
- An ecosystem for digital reticular chemistry☆45Updated 5 months ago
- ☆19Updated this week
- Pynta - an automated workflow for reaction path exploration on metallic surfaces☆35Updated this week
- ☆21Updated 4 years ago
- LAMMPS plugin for AiiDA☆25Updated last week
- Software for evaluating pareto-optimal synthesis pathways☆25Updated 8 months ago
- AlabOS: Managing the workflows in the Autonomous lab☆40Updated 4 months ago
- Online resource for a practical course in machine learning for materials research at Imperial College London (MATE70026)☆74Updated 2 weeks ago
- A Python library and command line interface for automated free energy calculations☆76Updated 2 months ago
- A graph database tool for experimental data in materials science and chemistry.☆16Updated last month