Hi Enyuan,
You can define the folp options separately for each unique potential, i.e.,

FOLP 0 1.0
FOLP 1 0.8
FOLP 2 1.2

Will give you touching muffin tins for the 0 potential (absorber),
and an overlap of 0.8 and 1.2 for the atoms with potential types 1 and 2 respectively. Note that the 0 potential will have not necessarily have "touching" muffin tin, since the 2 potential is larger than touching and could overlap the 0 potential. The third number gives the ratio of the muffin tin size to the touching muffin tin size that the cod would use if all FOLP radii were set to 1.0.
Cheers,
Josh Kas 

Cheers,
Josh Kas


On Sat, Nov 24, 2012 at 10:00 AM, <ifeffit-request@millenia.cars.aps.anl.gov> wrote:
Send Ifeffit mailing list submissions to
        ifeffit@millenia.cars.aps.anl.gov

To subscribe or unsubscribe via the World Wide Web, visit
        http://millenia.cars.aps.anl.gov/mailman/listinfo/ifeffit
or, via email, send a message with subject or body 'help' to
        ifeffit-request@millenia.cars.aps.anl.gov

You can reach the person managing the list at
        ifeffit-owner@millenia.cars.aps.anl.gov

When replying, please edit your Subject line so it is more specific
than "Re: Contents of Ifeffit digest..."


Today's Topics:

   1. FOLP card (Enyuan Hu)


----------------------------------------------------------------------

Message: 1
Date: Sat, 24 Nov 2012 08:55:58 -0500
From: Enyuan Hu <bearcharge@gmail.com>
To: ifeffit <ifeffit@millenia.cars.aps.anl.gov>
Subject: [Ifeffit] FOLP card
Message-ID:
        <CAJud35MQx-zvbvpPH1zbPitFXaUj9qm8TgoqEWsH9yCnwawRNA@mail.gmail.com>
Content-Type: text/plain; charset="iso-8859-1"

Dear all,

I'm trying to see the impact of using FOLP card on my simulation results in
Feff9. As far as I understand it, FOLP is defining the overlapping of
muffin-tin radii. The first parameter defines the the position where this
card will be used (expressed as potential type), right? so should I do the
simulation for all potentials, that is going from 0 to the last number in
my potential list, or I just do it for some specific positions (potential
types)? thanks.

Enyuan
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://millenia.cars.aps.anl.gov/pipermail/ifeffit/attachments/20121124/5e1e6332/attachment.html>

------------------------------

_______________________________________________
Ifeffit mailing list
Ifeffit@millenia.cars.aps.anl.gov
http://millenia.cars.aps.anl.gov/mailman/listinfo/ifeffit


End of Ifeffit Digest, Vol 117, Issue 20
****************************************