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Restyled by prettier-markdown #104

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Feb 18, 2024
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Restyled by prettier-markdown #104

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14 changes: 6 additions & 8 deletions README.md
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Expand Up @@ -5,11 +5,11 @@
[![Stable docs](https://img.shields.io/badge/docs-stable-blue.svg)](https://mineralscloud.github.io/qha/)
[![Build Status](https://travis-ci.com/MineralsCloud/qha.svg?branch=master)](https://travis-ci.com/MineralsCloud/qha)

| category | percent | downloads |
|-----------------|----------|-----------|
| with_mirrors | 100.00% | 2,801 |
| without_mirrors | 20.67% | 579 |
| Total | | 2,801 |
| category | percent | downloads |
| --------------- | ------- | --------- |
| with_mirrors | 100.00% | 2,801 |
| without_mirrors | 20.67% | 579 |
| Total | | 2,801 |

Date range: 2023-04-20 - 2023-10-17

Expand Down Expand Up @@ -84,8 +84,6 @@ If you want to plot your results, in the same folder, run
$ qha plot /path/to/settings.yaml
```



## Structure of the `qha` package

The `qha` source code consists of three major parts.
Expand Down Expand Up @@ -134,7 +132,7 @@ This main folder contains three folders, license file, readme file, and setup fi

`qha/v2p.py`: Contain the function `v2p` used to convert calculated properties on $(T, V)$ grid to $(T, P)$ grid;

`qha/input_maker.py`: Generate the input file for `qha` from results obtained from *ab initio* calculation;
`qha/input_maker.py`: Generate the input file for `qha` from results obtained from _ab initio_ calculation;

`qha/out.py`: Functions used to write calculated properties into files.

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