P
Pyscf

Projects with this topic

View pymbxas project

Fabrice Roncoroni / pymbxas

⚠️ Development has moved to GitHub: https://github.com/roncofaber/pymbxas. This GitLab project is retained as a read-only archive.

DFT quantum chem... Pyscf

Archived 2

Updated Aug 28, 2026

Archived 2 0 0 0

Updated Aug 28, 2026
View variational_mesh project

Wanja Schulze / variational_mesh

Optimize meshes for quantum chemistry calculations.

Python DFT Pyscf

1

Updated Nov 20, 2025

1 1 0 0

Updated Nov 20, 2025