Section EPR

• The g tensor is calculated by DFPT

• Section path: CP2K_INPUT / FORCE_EVAL / PROPERTIES / LINRES / EPR

• This section cannot be repeated.

• This section cites the following reference: [Weber2009]

• Subsections

  • INTERPOLATOR
  • PRINT

• Keywords

  • SECTION_PARAMETERS
  • RESTART_EPR

• Keyword descriptions

  SECTION_PARAMETERS
  	&EPR {Logical}
  	controls the activation of the epr calculation
  	This keyword cannot be repeated and it expects precisely one logical.
  	The lone keyword behaves as a switch to .TRUE.
  	Default value: .FALSE.

  RESTART_EPR
  	RESTART_EPR {Logical}
  	Restart the EPR calculation from a previous run (NOT WORKING)
  	This keyword cannot be repeated and it expects precisely one logical.
  	The lone keyword behaves as a switch to .TRUE.
  	Default value: .FALSE.