[Ifeffit] EXAFS modules

Hi Francisco, This depends on which version of FEFF you are using. The following shows the executables needed for EXAFS in feff9 and feff8. The names are different, so I have put the corresponding module in parentheses. FEFF9 FEFF8 rdinp rdinp atomic ffmod1 (atomic and pot) pot ffmod2 (xsph) xsph ffmod4 (path) path ffmod5 (genfmt) genfmt ffmod6 (ff2x) ff2x Cheers, Josh Kas

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Message: 1 Date: Mon, 13 Jun 2011 12:22:16 -0700 From: Francisco Garcia To: ifeffit@millenia.cars.aps.anl.gov Subject: [Ifeffit] EXAFS modules Message-ID: Content-Type: text/plain; charset=ISO-8859-1

Dear users,

Which of the following modules are needed to compute only the EXAFS spectra (that is, chi.dat)?:

ipot ixsph ifms ipaths igenfmt iff2x

Thank you.

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