QuantumDescent - Modified framework for deep learning representation of density functional theory Hamiltonian

For a detailed description, refer to the report

Architecure

pip install .
cd deeph
deeph-train --config ./default.ini

Name		Name	Last commit message	Last commit date
Latest commit History 31 Commits
AGNI-fp		AGNI-fp
build/lib/deeph		build/lib/deeph
deeph.egg-info		deeph.egg-info
deeph		deeph
plots		plots
.gitignore		.gitignore
README.md		README.md
project-report.pdf		project-report.pdf
setup.py		setup.py