PLANAR_AVERAGED_V_HARTREE

Define the parameters for calculating and printing the planar averaged electrostatic potential (Hartree potential) for symmetric slab systems [Edit on GitHub]

Keywords

• SECTION_PARAMETERS

• PARALLEL_PLANE

Keyword descriptions

SECTION_PARAMETERS

Type: logical
Default: F
Lone keyword: T
Usage: &PLANAR_AVERAGED_V_HARTREE ON

Description: Controls the activation of the planar averaged electrostatic potential (Hartree potential) section

[Edit on GitHub]

PARALLEL_PLANE

Type: enum
Default: XY
Usage: PARALLEL_PLANE XY

Description: The coordinate plane that the surface is parallel to.

Valid values:

• XY Parallel to XY

• YZ Parallel to YZ

• XZ Parallel to XZ

[Edit on GitHub]