Useful links
- Data - Computational Chemistry Comparison and Benchmark DataBase
- Data - EMSL Basis Set Exchange
- Data - IUPAC Gold Book
- Data - Materials Project
- Data - NIST
- Data - NOMAD - Novel Materials Dicovery
- Software - ABINIT
- Software - APE
- Software - CPMD
- Software - GAMESS
- Software - GPAW
- Software - NWCHEM
- Software - ORCA forum
- Software - Octopus
- Software - PSI4
- Software - xTB
