Re: [Ifeffit] problem with E0 (enot) parameters

2009-06-22 Thread Zajac, Dariusz A.
-boun...@millenia.cars.aps.anl.gov] On Behalf Of Matt Newville Sent: Saturday, June 20, 2009 5:41 PM To: XAFS Analysis using Ifeffit Subject: Re: [Ifeffit] problem with E0 (enot) parameters Hi Dariusz, Just to follow up on Stefan's request to not post large attachments to email: The ifeffit

Re: [Ifeffit] problem with E0 (enot) parameters

2009-06-20 Thread Stefan Mangold
: [Ifeffit] problem with E0 (enot) parameters Hi Darek, OK, so if the K, H, and O don't affect the fit much for the C and N, and the K, H, and O are returning nonsensical values, then a logical possibility is that the E0's for C and N are correct. If you add 12 eV to the E0 you chose in Athena, where

Re: [Ifeffit] problem with E0 (enot) parameters

2009-06-20 Thread joshua jason kas
results. Josh From: Frenkel, Anatoly fren...@bnl.gov Subject: Re: [Ifeffit] problem with E0 (enot) parameters To: XAFS Analysis using Ifeffit ifeffit@millenia.cars.aps.anl.gov, XAFS Analysis using Ifeffit ifeffit@millenia.cars.aps.anl.gov Message-ID

Re: [Ifeffit] problem with E0 (enot) parameters

2009-06-20 Thread Matt Newville
Hi Dariusz, Just to follow up on Stefan's request to not post large attachments to email: The ifeffit web page is a wiki, and would be an ideal place for posting the data (feff inputs, project files, images of plots) for such questions. You can read up on the wiki page for how to do create

Re: [Ifeffit] problem with E0 (enot) parameters

2009-06-19 Thread Scott Calvin
Of Scott Calvin Sent: Friday, June 19, 2009 12:23 PM To: XAFS Analysis using Ifeffit Subject: Re: [Ifeffit] problem with E0 (enot) parameters Hi Zajac, What happens if you constrain all E0's to be the same? In the fit where they come out large, what are the uncertainties in the E0's? What

Re: [Ifeffit] problem with E0 (enot) parameters

2009-06-19 Thread Kropf, Arthur Jeremy
...@millenia.cars.aps.anl.gov] On Behalf Of Zajac, Dariusz A. Sent: Friday, June 19, 2009 9:45 AM To: XAFS Analysis using Ifeffit Subject: Re: [Ifeffit] problem with E0 (enot) parameters Hi Scott, I am afraid that E0 jumps over the edge - see bmp's in the attachment (files with enot_12 means E0=12...). Hovewer 12 eV

Re: [Ifeffit] problem with E0 (enot) parameters

2009-06-19 Thread Frenkel, Anatoly
...@millenia.cars.aps.anl.gov] On Behalf Of Zajac, Dariusz A. Sent: Friday, June 19, 2009 9:45 AM To: XAFS Analysis using Ifeffit Subject: Re: [Ifeffit] problem with E0 (enot) parameters Hi Scott, I am afraid that E0 jumps over the edge - see bmp's in the attachment (files with enot_12 means E0=12...). Hovewer 12