Hi Mike,
On Sun, Dec 2, 2012 at 11:54 AM, Michael Morrill
wrote:
> Hello everyone,
>
> I am currently performing a simple curve fit on bulk MoS2 using an atoms file
> for crystalline MoS2. I've found that increasing k_min on my fit (e.g. from 2
> to 4) improves the quality of the fit (R-factor
Michael,
If you use the same kmin for the standard and the unknown you will minimize
the ambiguity.
Anatoly
- Reply message -
From: "Michael Morrill"
To: "ifeffit@millenia.cars.aps.anl.gov"
Subject: [Ifeffit] S02 and k_min
Date: Sun, Dec 2, 2012 1:02 PM
H
Hello everyone,
I am currently performing a simple curve fit on bulk MoS2 using an atoms file
for crystalline MoS2. I've found that increasing k_min on my fit (e.g. from 2
to 4) improves the quality of the fit (R-factor from 0.028 to 0.009), but also
increases S02. If I use a large enough k_min
