18 Jul
2018
18 Jul
'18
4:49 a.m.
Thanks Matt for briefing about those parameters. Actually the thing is, I don't have any literature support of the edge which I am simulating. And the experimental data with me is greatly differing from the simulated one, which is expected due to presence of some defects in crystal structure. So, with FEFF, I want to see the effect of defect introduction in crystal structure. But the confusion is lying for the choice of parameters which I could use for a particular simulation. Regards, Manju