Hello everybody,
I'm trying to make Co K-edge EXAFS fitting for the Co3O4 compound (*.cif
file is attached). The nearest neighbour of Co is oxigen at about 1.93
Angstrom distance.
Cobalt sits in two inequivalent sites in the unit cell. When I perform the
FEFF calculation in Artemis for either one
Hi Eugenio,
Quick question: Did you change the tags for the Co atoms so that they are
different?
If I do that, I get 4 and 6 coordinate results. you can import the cif file
twice, run atoms on both
sites (with tags different) and get the two feff inputs for running.
-R.
On Thu, Apr 9, 2015 at
