BSEHOLE: Difference between revisions
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{{TAGDEF|BSEHOLE|[ | {{TAGDEF|BSEHOLE|[real array]}} | ||
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. |
Revision as of 16:04, 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.
The position of the fixed particle is provided in direct (fractional) coordinates
Related tags and sections
BSE, BSEFATBAND, BSE calculations