[Pw_forum] unit of mode vectors in matdyn.modes

Paolo Giannozzi giannozz at democritos.it
Thu Dec 13 15:01:51 CET 2012


On Dec 13, 2012, at 14:03 , Paolo Giannozzi wrote:

>   ! (default: 'matdyn.modes'). The normalized phonon displacements
>   ! are the eigenvectors divided by the mass

oops, "divided by the square root of the mass" ...

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







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