[Pw_forum] Negative frequencies at really low threshold convergence
Paolo Giannozzi
giannozz at democritos.it
Fri Aug 24 12:06:56 CEST 2012
On Aug 23, 2012, at 20:46 , Elie M wrote:
> I still get that the three first values of the frequencies are
> negative.
> Does this confirm the instability of the system?
likely, but you should first of all verify the effect of applying the
Acoustic Sum Rule.
P.
---
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