3. Coordinate-space UHF (UHFr)

• 3.1. Tutorial
  • 3.1.1. Create a parameter file
  • 3.1.2. Create definition files for Hamiltonian
  • 3.1.3. Specify output components
  • 3.1.4. Run
• 3.2. File specifications
  • 3.2.1. Parameter file
  • 3.2.2. Input files for UHFr
  • 3.2.3. Output files for UHFr