CI_NEB
Controls parameters for CI-NEB type calculation only. [Edit on GitHub]
Keywords
Keyword descriptions
- NSTEPS_IT
Type: integer
Default: 5Description: Specify the number of steps of IT-NEB to perform before switching on the CI algorithm
Controls parameters for CI-NEB type calculation only. [Edit on GitHub]
Type: integer
Default: 5
Description: Specify the number of steps of IT-NEB to perform before switching on the CI algorithm