Is extraction of dipole moments from real-time TDDFT a Python command?

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7:25:07 AM PDT - Sat, May 16th 2015
All those commands are to be run from the command line, not inside an nwchem input file python block. fft1d is a MatLab or octave script and only needs the file name as an argument, i.e., octave -q fft1d.m x.dat > xw.dat ...unless you have explicitly set your desktop environment to execute .m files using octave. There is more information starting at page 159 in the user manual available at http://nwchemgit.github.io/images/NWChem6.5_Documentation.pdf -drh