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Merge branch 'dev' of https://github.com/MineralsCloud/cij into dev
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chazeon committed Nov 2, 2021
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Expand Up @@ -69,7 +69,8 @@ elast:
mode_gamma:
interpolator: spline
order: 3
system: cubic
symmetry:
system: cubic
output:
pressure_base:
- cij
Expand Down Expand Up @@ -154,6 +155,14 @@ See [GitHub pages][2].
[![codecov](https://codecov.io/gh/MineralsCloud/cij/branch/dev/graph/badge.svg?token=Ln1Fo4vNBE)](https://codecov.io/gh/MineralsCloud/cij)
[![pypi](https://img.shields.io/pypi/v/cij.svg)](https://pypi.org/project/cij/)

## How to cite

If you use this software in any publication, please cite:

Luo, C., Deng, X., Wang, W., Shukla, G., Wu, Z., & Wentzcovitch, R. M. (2021). cij: A Python code for quasiharmonic thermoelasticity. *Computer Physics Communications*, 108067. https://doi.org/10.1016/j.cpc.2021.108067

The paper is also available from arXiv: https://arxiv.org/abs/2101.12596

## Licence

Released under [GNU GPLv3](./LICENCE) license.

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