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Tilde Materials Informatics Lab

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optimade.science
A "sky-scanner" OPTIMADE browser-only GUI

HTML 5 MIT 3 7 (1 issue needs help) 2 Updated Aug 25, 2021
optimade-client
Isomorphic TypeScript / JavaScript client to aggregate all the official Optimade providers

TypeScript 3 MIT 0 3 (3 issues need help) 0 Updated Jul 14, 2021
awesome-materials-informatics
Curated list of known efforts in materials informatics

148 42 1 0 Updated Jun 9, 2021
aiida-crystal-dft
AiiDA plugin for the ab initio modeling suite CRYSTAL, developed in Turin University

Python 2 MIT 0 14 0 Updated May 17, 2021
pycrystal
Utilities for ab initio modeling suite CRYSTAL, developed in Turin University

Python 8 1 5 3 Updated Apr 24, 2021
tilde
Materials informatics framework for ab initio data repositories

Python 21 MIT 4 10 60 Updated Apr 22, 2021
yascheduler
Yet another cloud computing scheduler for the first-principles simulations of crystals

Python 2 0 6 0 Updated Apr 7, 2021
pyfactxx

Java 2 0 0 0 Updated Mar 27, 2021
cifplayer
Minimalistic and fast HTML5 visualization of chemical structures in CIF and POSCAR formats

HTML 7 MIT 1 6 0 Updated Jan 22, 2021
docker-aiida-crystal
A docker-compose multicontainer AiiDA setup for CRYSTAL17 code (inspired by docker-aiida-qepw).

TSQL 0 0 0 0 Updated Jul 27, 2020

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