[Pw_forum] warning in q2r.x

Subhradip Ghosh subhra at iitg.ernet.in
Mon Apr 21 04:01:44 CEST 2008


I am doing phonon calculations on a L10 structure. The output of q2r.x
produces the following warning:

"fft-check warning: sum of imaginary terms = .2454409E-06"

How serious is this warning and what could be the consequences? Also, what
could be the possible reasons?

Regards,

Subhradip


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              Dr. Subhradip Ghosh
              Assistant Professor
              Department of Physics
            Indian Institute of Technology
               Guwahati,Assam-781039
                    India
               E-mail:subhra at iitg.ernet.in
               Phone: +91 361 2582717(O)
                      +91 361 2584717(R)
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