Category:INCAR: Difference between revisions
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{{TAGDEF| | {{TAGDEF|EMAX|[real]}} | ||
{{DEF| | {{DEF|EMAX| lowest KS-eigenvalue + <math>\Delta</math> |}} | ||
Description: {{TAG| | Description: {{TAG|EMAX}} specifies the lower boundary of the energy range | ||
for the evaluation of the DOS | for the evaluation of the DOS | ||
---- | ---- | ||
The DOS is evaluated each {{TAG|NBLOCK}} steps, {{FILE|DOSCAR}} is updated each {{TAG|NBLOCK}}*{{TAG|KBLOCK}} steps. | The DOS is evaluated each {{TAG|NBLOCK}} steps, {{FILE|DOSCAR}} is updated each {{TAG|NBLOCK}}*{{TAG|KBLOCK}} steps. | ||
== Related Tags and Sections == | == Related Tags and Sections == | ||
{{TAG| | {{TAG|EMIN}}, {{TAG|NEDOS}}, | ||
{{FILE|DOSCAR}} | {{FILE|DOSCAR}} | ||
Revision as of 13:09, 31 August 2012
EMAX = [real]
| Default: EMAX | = 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.
Related Tags and Sections
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