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questions of damping effect
Hello Feff users,
I am now trying to simulate XANES for MgO.
According to literature, when calculating its
exchange potential, the multiplication factor
α(alpha) should be 2/3. Does anybody know
which code I should use to set up this value in
feff.inp file? Should I use AFLOP? If yes, is
1.67 the value I should put after AFLOP?
Anthoer question is about damping effect. If
I want to consider a -1.0ev damping, which code
should I use?
Thanks in advance,
Ni
Ni Zhao
Department of Materials Science and Engineering
Mcmaster University
1280 Main Street West
Hamilton, Ont. L8S 4L7, Canada
(905) 525-9140 Ext. 24544