Section PRINT

• Controls the printing properties during an MD run

• Section path: CP2K_INPUT / MOTION / MD / PRINT

• This section cannot be repeated and can be optional.

• Subsections

  • CENTER_OF_MASS
  • COEFFICIENTS
  • ENERGY
  • PROGRAM_RUN_INFO
  • ROTATIONAL_INFO
  • SHELL_ENERGY
  • TEMP_KIND
  • TEMP_SHELL_KIND

• Keywords

  • FORCE_LAST

• Keyword descriptions

  FORCE_LAST
  	FORCE_LAST LOGICAL
  	Print the output and restart file if walltime is reached or if an external EXIT command is given. It still requires the keyword LAST to be present for the specific print key (in case the last step should not match with the print_key iteration number).
  	This optional keyword cannot be repeated and it expects precisely one logical.
  	The lone keyword behaves as a switch to .TRUE.
  	Default value: .FALSE.