EMIN: Difference between revisions
No edit summary |
|||
| Line 16: | Line 16: | ||
{{FILE|DOSCAR}} | {{FILE|DOSCAR}} | ||
== | == Example Calculations using this Tag == | ||
{{TAG|bandstructure of SrVO3 in GW}} | {{TAG|bandstructure of SrVO3 in GW}} | ||
---- | ---- | ||
Revision as of 11:55, 15 February 2017
EMIN = [real]
| Default: EMIN | = lowest KS-eigenvalue - |
Description: EMAX 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