[Pw_forum] davico error while calculating projected density of states

Bipul Rakshit bipulrr at gmail.com
Mon Aug 10 10:12:41 CEST 2009


Dear PWSCF users,
I am doing calculation of LaMnO3. When I try to do the projected density of
states, then it shows the error

   Calling projwave ....

 %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
     from davcio : error #        10
     error while reading from file
 %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%

     stopping ...

I have first done the scf,
nscf
dos.x
then projwfc.x

kindly help me in this regard

-- 
Dr. Bipul Rakshit
Research Associate,
S N Bose Centre for Basic Sciences,
Salt Lake,
Kolkata 700 098
India
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