IRC_DIRECTION
IRC_DIRECTION = -1 | 1 |
Default: IRC_DIRECTION = 1
Description: TI_LAMBDA defines the coupling parameter used in Thermodynamic integration with harmonic reference. The value of must be from the inverval .
Mind: Scheduled downtime for maintenance on Jan 14, 2025 17:00-18:00 CET(UTC+01:00).
Requests for technical support from the VASP team should be posted in the VASP Forum.
IRC_DIRECTION = -1 | 1 |
Default: IRC_DIRECTION = 1
Description: TI_LAMBDA defines the coupling parameter used in Thermodynamic integration with harmonic reference. The value of must be from the inverval .