Metadata-Version: 2.1
Name: quantumsculpt
Version: 0.1.5
Summary: quantumsculpt
Home-page: https://gitlab.tue.nl/inorganic-materials-chemistry/quantumsculpt
Author: Ivo Filot
Author-email: Ivo Filot <i.a.w.filot@tue.nl>
Maintainer-email: Ivo Filot <i.a.w.filot@tue.nl>
License: GPL-3.0-or-later
Project-URL: Homepage, https://gitlab.tue.nl/
Project-URL: Bug Tracker, https://gitlab.tue.nl/inorganic-materials-chemistry/quantumsculpt/-/issues
Classifier: Programming Language :: Python :: 3
Classifier: Operating System :: OS Independent
Requires-Python: >=3.6
Description-Content-Type: text/markdown
License-File: LICENSE
Requires-Dist: numpy
Requires-Dist: scipy
Requires-Dist: matplotlib

# QuantumSculpt

[![pipeline status](https://gitlab.tue.nl/inorganic-materials-chemistry/quantumsculpt/badges/master/pipeline.svg)](https://gitlab.tue.nl/inorganic-materials-chemistry/quantumsculpt/-/commits/master)
[![Anaconda-Server Badge](https://anaconda.org/ifilot/quantumsculpt/badges/version.svg)](https://anaconda.org/ifilot/quantumsculpt)
[![PyPI](https://img.shields.io/pypi/v/pydft?color=green)](https://pypi.org/project/pytessel/)
[![License: GPL v3](https://img.shields.io/badge/License-GPLv3-blue.svg)](https://www.gnu.org/licenses/gpl-3.0)

QuantumSculpt is a bundle of Python scripts to analyze the electronic
structure of systems calculated using [VASP](https://www.vasp.at/). QuantumSculpt
is designed to operate on [VASP WAVECAR](https://www.vasp.at/wiki/index.php/WAVECAR) files 
and on the output files of [Lobster](http://www.cohp.de/), specifically DOS and COHP
type of files.

## Installation

### Anaconda

```bash
conda install -c ifilot quantumsculpt
```

### PyPi

```bash
pip install quantumsculpt
```

## Manual

See: https://quantumsculpt-inorganic-materials-chemistry-5002ad1bf06a7fa61a5.pages.tue.nl/
