8.5. Running Feff outside of Demeter

8.5.1. Using a single feffNNNN.dat file

You can import feffNNNN.dat files from a FEFF calculation run outside of DEMETER. Explicitly specify the folder and file.

$path -> new(data     => $data,
             folder   => './',
             file     => 'feff0001.dat',
             s02      => 'amp',
             e0       => 'enot',
             delr     => 'alpha*reff',
             sigma2   => 'debye(temp, theta) + sigmm',

8.5.2. Importing an external Feff calculation


Document Demeter::Feff::External

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