Basis Sets

• Goodness of Fit: What does the Goodness of Fit tell me in NoSpherA2? Why is it sometimes worse than in the IAM?
• Localised Calculations: Can I perform local QM calculations?
• Molecular Orbitals: Can I calculate localised Molecular Orbitals?
• ORCA: How do I install ORCA?
• Basis Set: When to use which Basis Set