LOCPROJ: Difference between revisions
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Description: by means of the {{TAG|LOCPROJ}}-tag one may specify a (set of) local function(s) on which the orbitals are to be projected. These projections are written to the {{FILE|PROJCAR}}, {{FILE|LOCPROJ}}, and {{FILE|vasprun.xml}} files. | Description: by means of the {{TAG|LOCPROJ}}-tag one may specify a (set of) local function(s) on which the orbitals are to be projected. These projections are written to the {{FILE|PROJCAR}}, {{FILE|LOCPROJ}}, and {{FILE|vasprun.xml}} files. | ||
---- | ---- | ||
* ''<sites>'' | |||
* ''<functions-Ylm-specs>'' | |||
* ''<functions-radial-specs>'' | |||
== The {{FILE|LOCPROJ}} file == | == The {{FILE|LOCPROJ}} file == | ||
== Related Tags and Sections == | == Related Tags and Sections == | ||
{{TAG|LORBIT}} | {{TAG|LORBIT}} | ||
Revision as of 16:04, 10 January 2017
LOCPROJ = <sites> : <functions-Ylm-specs> : <functions-radial-specs>
Default: LOCPROJ = None
Description: by means of the LOCPROJ-tag one may specify a (set of) local function(s) on which the orbitals are to be projected. These projections are written to the PROJCAR, LOCPROJ, and vasprun.xml files.
- <sites>
- <functions-Ylm-specs>
- <functions-radial-specs>