[Pw_forum] GIPAW: error in output

Paolo Giannozzi giannozz at democritos.it
Tue Oct 25 20:43:41 CEST 2011


On Oct 25, 2011, at 19:05 , Carlo Nervi wrote:

> It should be the line with dclamda (see below) - no idea how to  
> further
> help the developers ;-)

>             dclambda = CMPLX( - a(lbnd) / c(lbnd), 0.d0,kind=DP)

print c(lbnd), check if it is zero; if it is, try to find out where  
it comes
from. Does the same job work on other machines/compilers, by
the way?

P.
---
Paolo Giannozzi, Dept of Chemistry&Physics&Environment,
Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222







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