[Ifeffit] [ATOMS] supercell input file

Bruce Ravel bravel at bnl.gov
Fri Sep 19 10:21:45 CDT 2008

On Friday 19 September 2008 11:07:22 Kelly, Shelly wrote:
> You can also cheat by adding an Fe neighbor to the end that is not used and
> not close to any of the paths that you do use.

That may be easier than my work-around.  Good one!


 Bruce Ravel  ------------------------------------ bravel at bnl.gov

 National Institute of Standards and Technology
 Synchrotron Methods Group at NSLS --- Beamlines U7A, X24A, X23A2
 Building 535A
 Upton NY, 11973

 My homepage:    http://xafs.org/BruceRavel
 EXAFS software: http://cars9.uchicago.edu/~ravel/software/exafs/

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