All requests for technical support from the VASP group must be addressed to: vasp.materialphysik@univie.ac.at

FERWE

From Vaspwiki
Jump to: navigation, search

FERWE = [real array] 

Description: FERWE sets the occupancies of the states for ISMEAR=-2.


To set the occupancies, specify

 FERWE = f(1) f(2) f(3) ... f(NBANDS×Nk)

The occupancies must be specified for all bands and k-points. The band-index runs fastest. The occupancies must be between 0 and 1.

In case of spin-polarized calculations (ISPIN=2), FERWE sets the occupancies of the states in the up-spin channel. The occupancies of the states in the down-spin channel must be specified by means of the FERDO-tag.

Related Tags and Sections

FERDO, ISMEAR

Examples that use this tag


Contents