BSEHOLE: Difference between revisions

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Description: {{TAG|BSEHOLE}} sets the coordinates of the fixed hole in the exciton wavefunction calculated in BSE. The coordinates are provided in direct (fractional) coordinates.
Description: {{TAG|BSEHOLE}} sets the coordinates of the fixed hole in the exciton wavefunction calculated in BSE. The coordinates are provided in direct (fractional) coordinates.
The position of the fixed particle is provided in direct (fractional) coordinates
== Related tags and sections ==
== Related tags and sections ==
{{TAG|BSE}}, {{TAG|BSEFATBAND}}, [[BSE calculations]]
{{TAG|BSE}}, {{TAG|BSEFATBAND}}, [[BSE calculations]]

Revision as of 16:05, 7 February 2024

BSEHOLE = [real array] 

Description: BSEHOLE sets the coordinates of the fixed hole in the exciton wavefunction calculated in BSE. The coordinates are provided in direct (fractional) coordinates.

Related tags and sections

BSE, BSEFATBAND, BSE calculations

Examples that use this tag