The ABINIT Users Mailing List ( CLOSED )

[Xavier Gonze <gonze@pcpm.ucl.ac.be>]

Dear Nuno,

Use ANADDB, especially the input variable eivec :
http://www.abinit.org/Infos_v5.4/users/anaddb_help.html#eivec

Best,
Xavier

On 11 Aug 2007, at 00:11, Nuno A. G. Bandeira wrote:

> Hello all,
>
> Does anyone know if abinit can print out the geometry displacements  
> of the coordinates in a phonon spectrum calculation ?
> Just so the frequencies can be assigned to stretching/twisting of  
> bonds etc.
>
> Regards,
>
> --
> Nuno A. G. Bandeira, AMRSC
> Graduate researcher and molecular sculptor
> Inorganic and Theoretical Chemistry Group,
> Faculty of Science
> University of Lisbon - C8 building, Campo Grande,
> 1749-016 Lisbon,Portugal
> http://cqb.fc.ul.pt/intheochem/nuno.html
> Doctoral student @ IST,Lisbon
> --