Package Usage: pypi: dftd4
Python API of the DFT-D4 project
2 versions
Latest release: over 2 years ago
1 dependent package
83 downloads last month
View more package details: https://packages.ecosyste.ms/registries/pypi.org/packages/dftd4
View more repository details: http://repos.ecosyste.ms/hosts/GitHub/repositories/dftd4%2Fdftd4
Dependent Repos 1
digital-chemistry-laboratory/morfeus
A Python package for calculating molecular featuresSize: 7.26 MB - Last synced: 4 days ago - Pushed: 4 months ago
turkiAlturaifi/morfeus_try Fork of digital-chemistry-laboratory/morfeus
A Python package for calculating molecular featuresSize: 6.48 MB - Last synced: about 1 year ago - Pushed: almost 2 years ago
yanjordan/morfeus Fork of digital-chemistry-laboratory/morfeus
A Python package for calculating molecular featuresSize: 6.84 MB - Last synced: about 1 year ago - Pushed: about 3 years ago
wxj6000/gpu4pyscf Fork of pyscf/gpu4pyscf
A plugin to use Nvidia GPU in PySCF packageSize: 3.35 MB - Last synced: 5 days ago - Pushed: about 1 year ago
bytedance/gpu4pyscf Fork of pyscf/gpu4pyscf
This is a mirror repository of gpu4pyscf. Please refer to https://github.com/pyscf/gpu4pyscf for the latest development.Size: 7.4 MB - Last synced: 5 days ago - Pushed: 6 days ago
Open-Quantum-Platform/openqp
The main repository of Open Quantum Platform (OpenQP)Size: 39.6 MB - Last synced: about 1 month ago - Pushed: about 1 month ago
ntkachenko95/D4S
Implementation of D4S dispersion correctionSize: 304 KB - Last synced: 6 months ago - Pushed: 6 months ago
josevlibera2010/gfn2-xtb_paramfitter
Code for GFN2-xTB reparametrizationSize: 97.7 KB - Last synced: 29 days ago - Pushed: 29 days ago
