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Rescaling of the masses should be done at the interface level

Open henriquemiranda opened this issue 6 years ago • 0 comments

The re-scaling of the eigenvectors with the sqrt of the masses for phonopy should be done in the phonopy interface only. The interfaces should try to read the masses from the files and only otherwise get the mass from the atomic number

henriquemiranda avatar May 17 '18 09:05 henriquemiranda