4 projects
aiida-pyscf
AiiDA plugin for the Python-based Simulations of Chemistry Framework (PySCF).
aiida-nwchem
The official AiiDA plugin for NWChem
aiida-defects
AiiDA-Defects is a plugin for the AiiDA computational materials science framework, and provides tools and automated workflows for the study of defects in materials.
aiida-plumed
AiiDA plugin providing support for Plumed2