[Ifeffit] How to use ATOM on this file?

Wei Li weili at udel.edu
Fri May 4 21:50:06 CDT 2012

Hello, Bruce,

I have a *.cif, in which structure contains Zn and Al in the same site but
diferent ratio. I cannot use ATOM to build a cluster for Feff. I am wonder
if you could figure this out. Thanks in advance!

best wishes
Wei Li

Wei Li

Postdoc researcher
Environmental Soil Chemistry Group
Delaware Environmental Institute
University of Delaware, Newark,19713
http://ag.udel.edu/soilchem/li.html <http://ag.udel.edu/soilchem/>
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://millenia.cars.aps.anl.gov/pipermail/ifeffit/attachments/20120504/36a3e6a4/attachment.html>
-------------- next part --------------
A non-text attachment was scrubbed...
Name: ZnAlOHCl.cif
Type: application/octet-stream
Size: 9941 bytes
Desc: not available
URL: <http://millenia.cars.aps.anl.gov/pipermail/ifeffit/attachments/20120504/36a3e6a4/attachment.obj>

More information about the Ifeffit mailing list