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LULTRA-tag

$\displaystyle LULTRA =$   use ultrasoft PP$\displaystyle \qquad F \vert T
$

Default : .FALSE.


Determines, whether US pseudopotentials are created. The calculation of the US pseudopotentials is not done within rhfsps but within fourpot3. Actually for LULTRA=T, simply two sets of pseudo wave functions per l-quantum number are calculated. The first set is used by fourpot3 to set up the augmentation part, and the second pseudo wave function is used for the actual pseudopotential description.



N.B. Requests for support are to be addressed to: vasp.materialphysik@univie.ac.at