Section PRINT

• Collects all printing options related to the Wannier centers and properties computed with Wannier centers.

• Section path: CP2K_INPUT / ATOM / METHOD / XC / HF / RI / LOCALIZE / PRINT

• This section cannot be repeated.

• Subsections

  • LOC_RESTART
  • MOLECULAR_DIPOLES
  • MOLECULAR_MOMENTS
  • MOLECULAR_STATES
  • PROGRAM_RUN_INFO
  • TOTAL_DIPOLE
  • WANNIER_CENTERS
  • WANNIER_CUBES
  • WANNIER_SPREADS
  • WANNIER_STATES

• Keywords

  • none