23 Oct
2004
23 Oct
'04
1:46 p.m.
I did encounter that "No absorbing atom (ipot=0) defined" error sometimes, but I run Artemis only after I have feff calculations done.
I don't understand whether Feff ran to completion or not. Are you saying that you made a successful run of Feff (including real output files) but that Artemis still failed to read this calculation? That seems pretty strange.
By the way, I use FEFF8.
For Feff8, I believe you need to be much more careful about line endings. It's not able to use Windows line-endings on unixes, for example. But also: why would you use Feff8 for EXAFS analysis, as with artemis?? Feff8 is a XANES code. As far as I know, it does not give any improvements for EXAFS. --Matt