/abiflows

High-throughput calculations with Abinit
  1. Python 99.7%
  2. Shell 0.3%
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@gmatteo
gmatteo Use Abinit 8.10.1
Latest commit ac60962 Oct 21, 2018
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abiflows Version bumped to 0.5-dev Sep 4, 2018
dev_scripts Create legacy dir Jul 24, 2018
docs Add tasks.py, upgrade docs Sep 4, 2018
legacy Create legacy dir Jul 24, 2018
test_files updates (#9) Sep 4, 2018
.coveragerc Fix typo Jan 2, 2018
.gitignore more tests and updates Dec 1, 2017
.nojekill infrastructure for gh-pages Jul 17, 2018
.travis.yml Use Abinit 8.10.1 Oct 21, 2018
CHANGELOG.rst Add files for sphinx Dec 30, 2017
LICENSE Skeleton for docs Dec 2, 2017
README.rst badge Sep 4, 2018
requirements-optional.txt handle python-magic and filemagic libraries Jan 16, 2018
requirements.txt updates (#9) Sep 4, 2018
setup.cfg Add tasks.py, upgrade docs Sep 4, 2018
setup.py Add tasks.py, upgrade docs Sep 4, 2018
tasks.py fix mails Sep 4, 2018

README.rst

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About

Abiflows provides fireworks workflows to run several kind of DFT/DFPT simulations with Abinit.