Dear
I have some problem with a very easy simulation. Everytime I try to introduce
a potential with more elements, for instance
POTENTIALS
0 26 Fe
1 26 Fe
2 29 Cu
the program stops the simulation with a message that I do not understand and
that is attached to this mail. This
Hi Jenny,
I just wanted to add a bit to Matt's answer on TEY vs FY and suggest a
couple of reference for you.
There are three contributions to the TEY: photoelectrons, Auger
Electrons, and secondary electrons. The secondary electrons will
typically determine the maximum depth that you
Hi,
I can not find one small thing - sorting files in Athena - it makes me
crazy ;)
I work with QEXAFS data - usualy few tens of files or even more. Files
are named in such way: file_namerXX.fio where XX is next file number
(1, 2, 3, ... ,10, 11, 12, ... , 20, 21, etc.).
I use Iffefit under Win
Check out the section on marking groups in the Athena manual to see if
that meets your needs. This may not be the answer you're looking for, but
it's a way to sort data by selecting data sets that have a common
expression that matches your search parameters. The command is under Mark
then mark
It looks like the SCF calculation is having a hard time with the new
potential. The input file you sent only has atoms out to 2.48 Ang
(though perhaps you truncated it when posting???), but the
SCF 4 0 30 0.2 1
in your feff.inp means to make a self-consistent potential out to 4
Ang.
Hi Jeff,
Thanks -- you're right. I was only considering Auger electrons which
are more surface sensitive than the secondary electrons that actually
dominate most TEY measurements.
--Matt
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Hi,
I can not find one small thing - sorting files in Athena - it makes me
crazy ;)
I work with QEXAFS data - usualy few tens of files or even more. Files
are named in such way: file_namerXX.fio where XX is next file number
(1, 2, 3, ... ,10, 11, 12, ... , 20, 21, etc.).
I use Iffefit
