[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!
B
--
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
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