piwheels

pyxdh

Document and code of python and PySCF approach XYG3 type of density functional realization

Installation

In a virtualenv (see these instructions if you need to create one):

pip3 install pyxdh

Dependencies

• nbsphinx
• sphinxcontrib-bibtex
• pyberny
• jupyter
• docopt
• pandoc
• numpy
• codecov
• jupyter-contrib-nbextensions
• pyscf
• scipy
• sphinx
• sphinx-rtd-theme
• pytest-cov

Releases

Version	Released	Bullseye Python 3.9	Bookworm Python 3.11	Trixie Python 3.13	Files
0.0.7	2024-02-23
0.0.5	2020-05-13
pyxdh-0.0.5-py3-none-any.whl (60 KB)
0.0.4	2020-03-21
pyxdh-0.0.4-py3-none-any.whl (60 KB)
0.0.3	2019-10-06
pyxdh-0.0.3-py3-none-any.whl (59 KB)
0.0.2	2019-10-06
0.0.1	2019-09-17
pyxdh-0.0.1-py3-none-any.whl (45 KB)

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