CP2K_INPUT / FORCE_EVAL / DFT / XC / XC_POTENTIAL

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Input reference of CP2K version 6.1 (Revision svn:18464)

Section XC_POTENTIAL

The xc potential to use (CAREFUL: xc potential here refers to potentials that are not derived from an xc functional, but rather are modelled directly. Therefore there is no consistent xc energy available. To still get an energy expression, see ENERGY below

Section path: CP2K_INPUT / FORCE_EVAL / DFT / XC / XC_POTENTIAL

This section cannot be repeated.

Subsections
- SAOP

Keywords
- ENERGY

Keyword descriptions

ENERGY
	ENERGY {Keyword}
	How to determine the total energy.
	This keyword cannot be repeated and it expects precisely one keyword.
	Default value: NONE
	List of valid keywords: FUNCTIONAL Without description, yet. NONE Without description, yet. SOE Without description, yet. SUM_EIGENVALUES Without description, yet. XC_FUNCTIONAL Without description, yet.

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(Last update: 12.6.2018)