ESF NINTER: Difference between revisions
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Latest revision as of 14:09, 18 December 2024
ESF_NINTER = [integer]
Default: ESF_NINTER = 15
Description: ESF_NINTER sets the maximum number of interpolation steps for the electronic structure factor (ESF_SPLINES).
If the threshold set by ESF_CONV has not been reached within ESF_NINTER iterations VASP will print a warning about insufficient convergence.
Related tags and articles
ESF_SPLINES, ESF_CONV, LOPTICS