Category:INCAR: Difference between revisions
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{{TAGDEF| | {{TAGDEF|EMIN|[real]}} | ||
{{DEF| | {{DEF|EMIN| lowest KS-eigenvalue - <math>Delta</math> | ||
Description: {{TAG|MIN}} specifies the lower boundary of the energy range | |||
Description: {{TAG| | |||
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. | ||
'''Mind''': If you are not sure where the region of interest lies, set | |||
{{TAG|EMIN}} to a value larger than {{TAG|EMAX}} | |||
== Related Tags and Sections == | == Related Tags and Sections == | ||
{{TAG| | {{TAG|EMAX}}, {{TAG|NEDOS}}, | ||
{{FILE|DOSCAR}} | {{FILE|DOSCAR}} | ||
---- | ---- | ||
[[The_VASP_Manual|Contents]] | [[The_VASP_Manual|Contents]] | ||
[[Category: | [[Category:INCAR]] | ||
Revision as of 13:17, 31 August 2012
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
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