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Name: David Waroquiers
Type: User
Name: David Waroquiers
Type: User
High-throughput calculations with Abinit
The official github mirror of the Abinit repository. We welcome bug fixes and improvements. Note that most of the active developments are hosted on our https://gitlab.abinit.org/ server. Before embarking on making significant changes, please contact the Abinit group.
Open-source library for analyzing the results produced by ABINIT
The official repository for the AiiDA code
atomate is a powerful software for computational materials science and contains pre-built workflows.
atomate2 is a library of computational materials science workflows
First-principles statistical mechanical software for the study of multi-component crystalline solids
A simple, robust and flexible just-in-time job management framework in Python.
Be a master builder of databases of material properties. Avoid the Kragle.
automated feature engineering
The Fireworks Workflow Management Repo.
jobflow is a library for writing computational workflows.
MongoDB aggregation machine
data mining for Materials Science
matplotlib: plotting with Python
MODNet: a framework for machine learning materials properties
This repository implements supplementary useful functions for Python that are not part of the standard library. Examples include useful utilities like transparent support for zipped files etc.
Official NetworkX source code repository.
Specification of a common REST API for access to materials databases
Tools for implementing and consuming OPTiMaDe APIs in Python
Python framework for generating and validating pseudo potentials
Package for preforming benchmark calculations of abinitio codes
Python materials analysis library powering the Materials Project
Pymatgen-db provides an addon to the Python Materials Genomics (pymatgen) library (https://pypi.python.org/pypi/pymatgen) that allows the creation of Materials Project-style databases for management of materials data.
A mongo mocking library with an ephemeral MongoDB running in memory.
pyproject-flake8 (pflake8), a monkey patching wrapper to connect flake8 with pyproject.toml configuration
A declarative, efficient, and flexible JavaScript library for building user interfaces.
🖖 Vue.js is a progressive, incrementally-adoptable JavaScript framework for building UI on the web.
TypeScript is a superset of JavaScript that compiles to clean JavaScript output.
An Open Source Machine Learning Framework for Everyone
The Web framework for perfectionists with deadlines.
A PHP framework for web artisans
Bring data to life with SVG, Canvas and HTML. 📊📈🎉
JavaScript (JS) is a lightweight interpreted programming language with first-class functions.
Some thing interesting about web. New door for the world.
A server is a program made to process requests and deliver data to clients.
Machine learning is a way of modeling and interpreting data that allows a piece of software to respond intelligently.
Some thing interesting about visualization, use data art
Some thing interesting about game, make everyone happy.
We are working to build community through open source technology. NB: members must have two-factor auth.
Open source projects and samples from Microsoft.
Google ❤️ Open Source for everyone.
Alibaba Open Source for everyone
Data-Driven Documents codes.
China tencent open source team.