HAIRY_PROBES

Section can be repeated.

Sets up a Hairy Probe calculation. [Edit on GitHub]

Keywords

• SECTION_PARAMETERS

• ALPHA

• ATOM_IDS

• EPS_HP

• MU

• T

Keyword descriptions

SECTION_PARAMETERS

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

Description: Controls the activation of hairy probe

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ALPHA

Type: real
Default: 1.00000000E+000
Usage: ALPHA

Description: Parameter for solution probes

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ATOM_IDS

Type: integer[ ]
Usage: ATOM_IDS ..

Description: Indexes of the atoms to which the probes are attached.

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EPS_HP

Type: real
Default: 1.00000000E-005
Usage: EPS_HP

Description: Tolerance for accuracy checks on occupation numbers calculated using hair-probes.

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MU

Type: real
Default: 0.00000000E+000 [eV]
Usage: MU

Description: Chemical potential of the electrons in the probes [eV]

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T

Type: real
Default: 3.00000000E+002 [K]
Usage: T

Description: Electronic temperature [K]

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