Category:INCAR

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EMIN = [real]  {{DEF|EMIN| lowest KS-eigenvalue - Description: MIN specifies the lower boundary of the energy range for the evaluation of the DOS


The DOS is evaluated each NBLOCK steps, DOSCAR is updated each NBLOCK*KBLOCK steps.

Mind: If you are not sure where the region of interest lies, set EMIN to a value larger than EMAX

Related Tags and Sections

EMAX, NEDOS, DOSCAR


Contents

Pages in category "INCAR"

The following 7 pages are in this category, out of 7 total.