roberto

Last released Jun 13, 2022

Collection of configurable development workflows

qc-procrustes

Last released Feb 26, 2022

Procrustes Package

qc-iodata

Last released Jul 6, 2021

Python Input and Output Library for Quantum Chemistry.

cardboardlint

Last released Aug 26, 2020

Cheap lint solution for PRs.

iodata

Last released Aug 16, 2020

Python Input and Output Library for Quantum Chemistry.

derivcheck

Last released Jun 20, 2019

A robust and very sensitive tester for analytic derivatives.

gbasis

Last released Nov 9, 2017

pycydemo

Last released Nov 8, 2017

Demo python+cython project