Exabyte-io / materials-designerLinks
A standalone React.js/Redux based web application for the design and visualization of atomistic materials structures. Used at Mat3ra.com and can be deployed in standalone mode.
☆13Updated 3 weeks ago
Alternatives and similar repositories for materials-designer
Users that are interested in materials-designer are comparing it to the libraries listed below
Sorting:
- Minimalistic and fast HTML5 visualization of chemical structures in CIF, POSCAR, and OPTIMADE formats☆29Updated last week
- MatID is a python package for identifying and analyzing atomistic systems based on their structure. MatID is designed to help researchers…☆23Updated last year
- Electron Density Plotter☆38Updated 7 months ago
- A general forcefield for phonon properties of metal-organic frameworks☆13Updated 5 years ago
- Browser plugin-free CIF visualization: comparison of the open-source engines☆22Updated 5 years ago
- Row is a command line tool that helps you manage workflows on HPC resources.☆14Updated last week
- Materials informatics framework for ab initio data repositories☆18Updated 3 years ago
- Calculate the required k-point density from the input geometry for periodic quantum chemistry calculations☆23Updated 2 years ago
- A tool for calculating distortion parameters in coordination complexes.☆16Updated 4 months ago
- A collection of crystal structures from first-principles simulations☆35Updated 5 years ago
- Tutorials, notebooks, issue tracker, and website on the MPDS API: the data retrieval interface for the Materials Platform for Data Scienc…☆26Updated 2 weeks ago
- Code to analyse thermodynamics of alloys through the generalized quasi-chemical approximation (GQCA)☆15Updated 5 years ago
- This is the proof of concept, how a relatively unsophisticated statistical model trained on the large MPDS dataset predicts physical prop…☆11Updated 10 months ago
- ☆18Updated 9 months ago
- WhereWulff: A semi-autonomous workflow for systematic catalyst surface reactivity under reaction conditions☆32Updated last year
- Yaff is yet another force-field code☆37Updated 2 years ago
- An embeddable webGL molecule viewer and file format converter.☆86Updated 3 years ago
- Set of scripts for working with Topas☆16Updated 5 months ago
- Examples of using the Atomic Simulation Environment☆37Updated 9 years ago
- Registry for BIG-MAP apps and codes. Find the apps☆10Updated this week
- Display and Edit Molecules (https://zndraw.icp.uni-stuttgart.de)☆46Updated last week
- Grand canonical optimization of grain boundary phases.☆27Updated 4 months ago
- Pymatgen-db provides an addon to the Python Materials Genomics (pymatgen) library (https://pypi.python.org/pypi/pymatgen) that allows the…☆50Updated last week
- A python package to deconstruct MOFs into building units, compute porosity, remove unbound guests and compute cheminfomatic data of build…☆21Updated 5 months ago
- Tools for handling CIF files, and CIF parsers used for the Crystallography Open Database (COD)☆21Updated 4 months ago
- A package to process electrochemical results from atomistic simulations.☆15Updated 2 months ago
- A post-processing engine for particle simulations☆45Updated 3 weeks ago
- Python python toolset for Structure-Informed Property and Feature Engineering with Neural Networks. It offers unique advantages through (…☆25Updated last week
- Clean, Uniform and Refined with Automatic Tracking from Experimental Database (CURATED) COFs☆39Updated last year
- Python framework for generating and validating pseudo potentials☆46Updated last year