[Pw_forum] USPP are not implemented
Lorenzo Paulatto
paulatto at sissa.it
Sun Aug 2 20:26:46 CEST 2009
On Sun, August 2, 2009 10:10, Neel Singh wrote:
> I was calculating the optical properties and during
> epsilon calculation, I got
> from grid_build : error # 1
> USPP are not implemented
Dear Neel,
why are you sending the same email over and over? We got it correctly the
first time.
The error means that the calculation you are trying to do is not
implemented for USPP (ultra-soft pseudo-potential). Either use
norm-conserving only, or develop it for ultrasoft.
cheers
--
Lorenzo Paulatto
SISSA & DEMOCRITOS (Trieste)
phone: +39 040 3787 511
skype: paulatz
www: http://people.sissa.it/~paulatto/
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