[Pw_forum] problem in phonon DOS calculation of HCP structure

Paolo Giannozzi giannozz at nest.sns.it
Tue Nov 1 20:13:03 CET 2005


On Tuesday 01 November 2005 10:55, Eduardo Ariel Menendez P wrote:

> I encountered the same error using matdyn.x as Yi Kong. 
> A common point is that it happens for an hexagonal structure
> too. Is there already any solution to that?

no, but you might contribute to the solution by finding exactly
under which conditions this happens, or even by providing
an example that doesn't take hours to run

P.

-- 
Paolo Giannozzi             e-mail:  giannozz at nest.sns.it
Scuola Normale Superiore    Phone:   +39/050-509876, Fax:-563513 
Piazza dei Cavalieri 7      I-56126 Pisa, Italy



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