Atomic Code Documentation

Bernd Pfrommer

Thu Oct 10 18:58:35 PDT 1996

• The Executable
• The INP file
  • Different Jobs
  • Different Flavors
  • Which element, what exchange-correlation functional
  • Core and valence orbital information
  • Cutoff radii
• The OUT file
• Looking at wave functions and potentials
• Kleinman-Bylanderization