[Pw_forum] Wrong frequencies on STO phonons

Paolo Giannozzi giannozz at democritos.it
Mon Jul 23 21:19:07 CEST 2012


On Jul 23, 2012, at 20:21 , Alejandro Rébola wrote:

> The solution was to use the 5.0 version.

funny: I am not aware of any recently fixed bug in the phonon
calculation. Anyway, thank you for reporting this

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







More information about the users mailing list