[SIESTA-L] error while running ae.sh script

hi... i am trying to run the ae.sh script to see the DATA files..but i get following error siesta-2.0.2/Pseudo/atom/Tutorial/All_electron # sh ../ae.sh si.ae.inp *../ae.sh: line 32: ../../../atm: No such file or directory* == Output data in directory si.ae

Re: [SIESTA-L] Phonon-DOS

Hei, It might be possible for IR intensities using ase package (https://wiki.fysik.dtu.dk/ase/). Unfortunately the ASE-implementation does not fully support siesta calculation for IR intensities (the calculation of dipole moment is not there for siesta but it should be easy to add). Alternatively