[Pw_forum] Wrong frequencies on STO phonons

Paolo Giannozzi giannozz at democritos.it
Fri Jul 20 13:48:17 CEST 2012


On Fri, 2012-07-20 at 04:27 -0500, "Alejandro Rébola" wrote:

> The problem is that I'm obtaining mostly negative frequencies

"mostly"? I see 3 negative frequencies at Gamma, 2 at (0,0,0.0503)

P.
-- 
Paolo Giannozzi, IOM-Democritos and University of Udine, Italy





More information about the users mailing list