EMAX: Difference between revisions
No edit summary |
|||
Line 12: | Line 12: | ||
{{FILE|DOSCAR}} | {{FILE|DOSCAR}} | ||
== | == Example Calculations using this Tag == | ||
{{TAG|bandstructure of SrVO3 in GW}} | {{TAG|bandstructure of SrVO3 in GW}} | ||
---- | ---- |
Requests for technical support from the VASP team should be posted in the VASP Forum.
Upcoming workshop on chemical reactions! Go to event.
No edit summary |
|||
Line 12: | Line 12: | ||
{{FILE|DOSCAR}} | {{FILE|DOSCAR}} | ||
== | == Example Calculations using this Tag == | ||
{{TAG|bandstructure of SrVO3 in GW}} | {{TAG|bandstructure of SrVO3 in GW}} | ||
---- | ---- |
EMAX = [real]
Default: EMAX | = highest KS-eigenvalue + |
Description: EMAX specifies the upper 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.