ENAUG: Difference between revisions

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{{TAGDEF|ENAUG|[real]|largest {{TAG|EAUG}} read from the {{FILE|POTCAR}} file}}
{{TAGDEF|ENAUG|[real]|largest {{TAG|EAUG}} read from the {{FILE|POTCAR}} file}}


Description:
Description: {{TAG|ENAUG}} specifies the cut-off energy for the augmentation charges in eV.
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{{TAG|ENAUG}} determines {{TAG|NGXF}}, {{TAG|NGYF}}, and {{TAG|NGZF}}, in accordance with the {{TAG|PREC}}-tag.
== Related Tags and Sections ==
== Related Tags and Sections ==
{{TAG|NGXF}},
{{TAG|NGXF}},

Revision as of 13:38, 25 March 2011

ENAUG = [real]
Default: ENAUG = largest EAUG read from the POTCAR file 

Description: ENAUG specifies the cut-off energy for the augmentation charges in eV.


ENAUG determines NGXF, NGYF, and NGZF, in accordance with the PREC-tag.

Related Tags and Sections

NGXF, NGYF, NGZF, ENCUT, PREC, PRECFOCK


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