KERNEL TRUNCATION/LTRUNCATE: Difference between revisions
(Created page with "{{TAGDEF|KERNEL_TRUNCATION/LTRUNCATE_COULOMB_KERNEL| .True. {{!}} .False.|.False.}} Description: {{TAG|KERNEL_TRUNCATION/LTRUNCATE_COULOMB_KERNEL}} truncates the coulomb kernel to remove electrostatic interactions along non-periodic dimensions ----") |
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Description: {{TAG|KERNEL_TRUNCATION/LTRUNCATE_COULOMB_KERNEL}} truncates the coulomb kernel to remove electrostatic interactions along non-periodic dimensions | Description: {{TAG|KERNEL_TRUNCATION/LTRUNCATE_COULOMB_KERNEL}} truncates the coulomb kernel to remove electrostatic interactions along non-periodic dimensions | ||
---- | ---- | ||
Setting {{TAG|KERNEL_TRUNCATION/LTRUNCATE_COULOMB_KERNEL}} to .True. switches on coulomb kernel truncation methods. These methods removes interactions with periodic replicas in non-periodic directions. | |||
{{NB|mind|This tag acts as a "super-tag", i.e. unless this tag is switched on further options in KERNEL_TRUNCATION will be ignored.}} | |||
Revision as of 08:59, 15 October 2024
KERNEL_TRUNCATION/LTRUNCATE_COULOMB_KERNEL = .True. | .False.
Default: KERNEL_TRUNCATION/LTRUNCATE_COULOMB_KERNEL = .False.
Description: KERNEL_TRUNCATION/LTRUNCATE_COULOMB_KERNEL truncates the coulomb kernel to remove electrostatic interactions along non-periodic dimensions
Setting KERNEL_TRUNCATION/LTRUNCATE_COULOMB_KERNEL to .True. switches on coulomb kernel truncation methods. These methods removes interactions with periodic replicas in non-periodic directions.
| Mind: This tag acts as a "super-tag", i.e. unless this tag is switched on further options in KERNEL_TRUNCATION will be ignored. |