[Pw_forum] Calculation of dynamical matrices

Paolo Giannozzi giannozz at democritos.it
Tue Mar 20 11:29:38 CET 2012


On Mon, 2012-03-19 at 23:23 -0700, henry odhiambo wrote:

> I only get the dynamical matrices dyn1 and dyn2 whereas
> in the QE examples, they should be from dyn1 to dyn8
> 
> no, they should be from dyn1 to dynN, where N is the number
> of wavevectors (q) that are inequivalent by symmetry.

no, they should be from dyn1 to dynN, where N is the number
of wavevectors (q) that are inequivalent by symmetry.

You should look into the output file to understand why the
code has stopped

P.
-- 
Paolo Giannozzi, IOM-Democritos and University of Udine, Italy





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