[PW_Forum] Phonon Calculation Problem

Paolo Giannozzi giannozz at nest.sns.it
Mon Jul 18 18:31:12 CEST 2005


On Monday 18 July 2005 17:13, John B Burdette wrote:

>      I am trying to run ph.x for phonon calculations of TiO2
> in rutile form.  However, when I have created my input file,
> along with already running the TiO2 through the pw.x program,
> I receive the following error: [...]
>      from  read_restart_pseudo           : error #         1
>       wrong size

if this happens reproducibly, please provide a test that can be
rerun (i.e. complete with pseudopotentials or pointers to where 
they are) and a brief description of your "experimental setup"
(i.e. code version, compiler, ...)

Paolo

-- 
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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