Pinned Repositories
optimade-python-tools
Tools for implementing and consuming OPTIMADE APIs in Python
amset
Electronic transport properties from first-principles calculations
cgcnn
Crystal graph convolutional neural networks for predicting material properties.
dft-input-gen
Python library to generate input files for DFT codes.
magpie_workflow
nucodingclub
optimade-python-tools
Tools for implementing and consuming OPTiMaDe APIs in Python
oqmd-optimade-tutorial
Tutorial on OQMD data retrieval using OPTIMADE and building an ML model
qmpy
A suite of computational materials science tools.
qmpy
A suite of computational materials science tools.
tachyontraveler's Repositories
tachyontraveler/cgcnn
Crystal graph convolutional neural networks for predicting material properties.
tachyontraveler/dft-input-gen
Python library to generate input files for DFT codes.
tachyontraveler/oqmd-optimade-tutorial
Tutorial on OQMD data retrieval using OPTIMADE and building an ML model
tachyontraveler/qmpy
A suite of computational materials science tools.
tachyontraveler/amset
Electronic transport properties from first-principles calculations
tachyontraveler/DataSciNights
tachyontraveler/magpie_workflow
tachyontraveler/nucodingclub
tachyontraveler/optimade-python-tools
Tools for implementing and consuming OPTiMaDe APIs in Python
tachyontraveler/diel-design-scripts
Raw scripts used in an article describing a materials design workflow
tachyontraveler/docs-qmpy_rest
Documentation for RESTful API implemented at oqmd.org
tachyontraveler/emc
Effective Mass Calculator for Semiconductors
tachyontraveler/IBM_2020Challenge_Solutions
tachyontraveler/icsd-queryer
A python module to query data programmatically from the ICSD.
tachyontraveler/IntroToDB_Project
Class project
tachyontraveler/JCC-Curriculum-2019
tachyontraveler/may4_challenge_exercises
Original versions of the exercises
tachyontraveler/my_ml_service
My Machine Learning Web Service
tachyontraveler/OptimizationProject495
Project for EECS 495 (Northwestern University). Fall,2018.
tachyontraveler/providers
This repository hosts the providers.json file for OPTIMADE that lists reserved database-specific prefixes and URLs to the index databases of all database providers that participate in the OPTIMADE network
tachyontraveler/qmpy_rester
A toolkit for querying data in OQMD.
tachyontraveler/supercell-core
Package for investigation of mulitlayer 2D heterostructures' lattices (Work in progress!)
tachyontraveler/workshop-graphql-netflix