hfsolver

Hartree Fock solver

OTHER License

Stars
26
View Code on GitHub View on X
Ecosystems: Jupyter Notebook

Statistics for this project are still being loaded, please check back later.

Related Projects
off_psi4

Quanformer is a Python-based pipeline for generating conformers, preparing quantum mechanical (QM...

14 Oct 2016 0
python_1d_dft

1D density functional theory code in Python

17 Nov 2018 109
OpenFermion

The electronic structure package for quantum computers.

21 Sep 2017 1,512
boptimol

Bayesian geometry optimization experiments

27 May 2023 3
chem1000

Jupyter Noteboks for lecture and assignments for CHEM 1000: Mathematics for Chemistry at Universi...

19 Jun 2020 21