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Right stoichiometry
Dear users,
I am starting to use feff8.20 for calculations of ELNES. My spectrum has
3 edges overlapped.
I would like to ask you some advice about how to add properly the
calculated ELNES. I am actually adding the absolute cross-sections as
indicated in page 42 in the manual. Because we are dealing with a
compound of the type AmXn my question is how to consider the
right stoichiometry.
I think that the stoichiometry is implicit in the list of atoms generated
with the crystal structure data but I am not completely sure about this
point.
Is it OK or should we multiply each calculated curve by m or n?.
Thank you in advance for your help.
Sergio.
--
M. Sergio Moreno
Centro Atómico Bariloche
8400 - San Carlos de Bariloche
Argentina