[Ifeffit] Stand Alone Atoms

[Yasin Deep]

Dear All,

I want to calculate bond lengths of the SrFe2As2 parent compound for E//ab
and E//c polarization with stand-alone atoms pack of the Demeter. How can I
calculate bond lengths for these two different polarizations? There is a
panel for polarization vector I guess that panel I should adjust. I should
put (0,0,1) for E//c and E//ab (1,1,0) is this correct? What should I put
let's say for 30 degrees of polarization? Thank you in advance,

Dr. Yasin HACISALIHOGLU
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://millenia.cars.aps.anl.gov/pipermail/ifeffit/attachments/20230413/adc606fc/attachment-0001.htm>
-------------- next part --------------
A non-text attachment was scrubbed...
Name: Untitled.png
Type: image/png
Size: 385388 bytes
Desc: not available
URL: <http://millenia.cars.aps.anl.gov/pipermail/ifeffit/attachments/20230413/adc606fc/attachment-0001.png>
-------------- next part --------------
A non-text attachment was scrubbed...
Name: SrFe2As2_90K.cif
Type: application/octet-stream
Size: 1652 bytes
Desc: not available
URL: <http://millenia.cars.aps.anl.gov/pipermail/ifeffit/attachments/20230413/adc606fc/attachment-0001.obj>