Feng, Matt, The problem appears to be caused by a error in parsing the Titles portion of this one particular ATOMS.INP file. If you delete the entire reference #2 in the titles area WEBAtoms runs fine. (refer2: Cava, et al, Physica C 165, p.419, (1990)). Error can be reproduced by: 1) Choose YBa2Cu3O7.inp : yttrium barium copper oxide ( 123 , ybco) entry in http://cars9.uchicago.edu/cgi-bin/atoms/Atoms-Search.cgi and run WebAtoms 2) Choose K-edge 3) Run ATOMS (You will see the ERROR ACCESS Denied) The work around: 1) Choose YBa2Cu3O7.inp : yttrium barium copper oxide ( 123 , ybco) entry in http://cars9.uchicago.edu/cgi-bin/atoms/Atoms-Search.cgi and run WebAtoms 2) Choose K-edge 3) Delete (refer2: Cava, et al, Physica C 165, p.419, (1990)) in the header. 4) Run ATOMS (and it now works fine). Dave
-----Original Message----- From: ifeffit-bounces@millenia.cars.aps.anl.gov [mailto:ifeffit-bounces@millenia.cars.aps.anl.gov] On Behalf Of Feng Wang Sent: Wednesday, February 07, 2007 2:01 AM To: XAFS Analysis using Ifeffit Subject: Re: [Ifeffit] ERROR in getting feff8 input file for YBCO from Webatoms
Thank you, Paul, for clarifying this problem.
Sincerely,
Feng
Just to follow on this -- I can access the YBCO atoms entry (via a search). The atoms.inp pops up correctly, but when I attempted to run atoms, I got the same error message. The error doesn't come from my end (as far as I can tell). The problem seems to be with the execution of atoms (e.g. hitting the button "Run atoms".). The cgi is probably broken.
Paul
ERROR
Access Denied
Access Denied by security policy The security policy for your network prevents your request from being allowed at this time. Please contact your administrator if you feel this is incorrect.
On Feb 3, 2007, at 2:42 AM, Matt Newville wrote:
Hi Feng,
Sorry for the trouble. I'm not sure where the problem is. I can get files from the Atoms archive from home (ie, outside the Argonne network), and I don't see any recent errors in the logs, suggesting that both the server connections and the access through the Argonne and APS firewalls are working. Could it be that the trouble is at your end?
Perhaps we can troubleshoot this a little better. Does the 'search for Atoms.inp' page http://cars9.uchicago.edu/~newville/adb/search.html appear for you? Is it responsive?
Can you select a central atoms, a structure, and then hit 'Run Webatoms'?
Can you browse to http://cars9.uchicago.edu/atomsdb/ and see a large number of atoms.inp files? Can you select and download some of these files?
Hope that helps,
--Matt _______________________________________________ Ifeffit mailing list Ifeffit@millenia.cars.aps.anl.gov http://millenia.cars.aps.anl.gov/mailman/listinfo/ifeffit
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