DOCI module for PySCF

2021-02-27

• Version 0.1

Install

• Install to python site-packages folder

pip install git+https://github.com/pyscf/doci

• Install in a custom folder for development

git clone https://github.com/pyscf/doci /home/abc/local/path

# Set pyscf extended module path
echo 'export PYSCF_EXT_PATH=/home/abc/local/path:$PYSCF_EXT_PATH' >> ~/.bashrc

You can find more details of extended modules in the document extension modules