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: {{TAG|ENAUG}} specifies the cut-off energy | Description: {{TAG|ENAUG}} specifies the cut-off energy of the plane wave representation of 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. | {{TAG|ENAUG}} determines {{TAG|NGXF}}, {{TAG|NGYF}}, and {{TAG|NGZF}}, in accordance with the {{TAG|PREC}}-tag. | ||
Revision as of 13:43, 25 March 2011
ENAUG = [real]
Default: ENAUG = largest EAUG read from the POTCAR file
Description: ENAUG specifies the cut-off energy of the plane wave representation of 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