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v0.9.9 (#131)
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* Up to 0.9.9
* Update recommended citation
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ml-evs authored Oct 16, 2020
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10 changes: 10 additions & 0 deletions CHANGELOG.rst
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Changelog
=========

New in release (0.9.9) [16/10/2020]
-----------------------------------

- Added support for CASTEP kpoint path ``BREAK`` directive (#107)
- Improvements to magres plotting and magres workflow (#112)
- Added ability to scrape electric field gradient values and compute quadrupolar quantities from NMR calculations (#115)
- Added ability to run all several examples under Binder (#106, #130).
- JOSS paper accepted! (#129)


New in release (0.9.8) [10/08/2020]
-----------------------------------
- Improvements to PDIS functionality (#94).
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7 changes: 5 additions & 2 deletions README.rst
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Citing matador
--------------

If you use matador in your work, we kindly ask that you cite the source code archive on Zenodo:
If you use matador in your work, we kindly ask that you cite

Matthew Evans, ml-evs/matador (2020), Zenodo. http://doi.org/10.5281/zenodo.3908574
Matthew Evans, Andrew Morris, *matador: a Python library for analysing, curating and performing high-throughput density-functional theory calculations* Journal of Open Source Software (2020)
`URL <https://joss.theoj.org/papers/4d0eea9bea4362dec4cb6d62ebccc913>`_

Source code archives for all versions above 0.9 can be found at Zenodo `DOI 10.5281/zenodo.3908573 <https://doi.org/10.5281/zenodo.3908573>`_.


.. |PyPI Version| image:: https://img.shields.io/pypi/v/matador-db?label=PyPI&logo=pypi
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2 changes: 1 addition & 1 deletion matador/__init__.py
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__all__ = ['__version__']
__author__ = 'Matthew Evans'
__maintainer__ = 'Matthew Evans'
__version__ = "0.9.8"
__version__ = "0.9.9"

script_epilog = f"Written and maintained by Matthew Evans ([email protected]) 2016-2020, version {__version__}."

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