Hi, I tried Mary Shelly's suggestion to increase the resolution for my Windows XP monitor and this worked. Now I can run ATOMS from Artemis. Now the following happens: Running simple copper metal I generate an input file for FEFF that looks o.k. to me. I run FEFF and it generates paths that make sense....12 near neighbors of the right distance and so on. The Cu CHI function data is imported o.k. and a FT is displayed that looks fine. But the expected path input dialog box never comes up. According to the manual, once I start FEFF this dialog box is supposed to pop up asking how many paths I want to import and THEN FEFF is supposed to compute. The dialog box step is skipped. It says "message dumped to ENV-IFEFFIT-DIR-\HORAE\STASH\ARTEMIS.TRAP" I don't know where to look for this message , or why the dialog box never shows up. Any suggestions? Sincerely, Doug Pease
Doug: Again, I am not using this in Windows but I suggest that you use the "Find Files" feature to seaerch for the file named ARTEMIS.TRAP. Then you can read the error report. Carlo On Thu, 10 Jun 2004, doug pease wrote:
Hi,
I tried Mary Shelly's suggestion to increase the resolution for my Windows XP monitor and this worked. Now I can run ATOMS from Artemis. Now the following happens: Running simple copper metal I generate an input file for FEFF that looks o.k. to me. I run FEFF and it generates paths that make sense....12 near neighbors of the right distance and so on. The Cu CHI function data is imported o.k. and a FT is displayed that looks fine. But the expected path input dialog box never comes up. According to the manual, once I start FEFF this dialog box is supposed to pop up asking how many paths I want to import and THEN FEFF is supposed to compute. The dialog box step is skipped. It says "message dumped to ENV-IFEFFIT-DIR-\HORAE\STASH\ARTEMIS.TRAP"
I don't know where to look for this message , or why the dialog box never shows up. Any suggestions?
Sincerely,
Doug Pease
-- Carlo U. Segre -- Professor of Physics Associate Dean for Special Projects, Graduate College Illinois Institute of Technology Voice: 312.567.3498 Fax: 312.567.3494 segre@agni.phys.iit.edu http://www.iit.edu/~segre
participants (2)
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Carlo U. Segre
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doug pease