Hi folks, It just occured to me that I didn't mention the web page where I document all the changes to my codes in the most recent release. Athena especially has a number of interesting new features. You might want to take a look at this http://cars9.uchicago.edu/iffwiki/HoraeVersion062 B -- Bruce Ravel ---------------------------------------------- bravel@anl.gov Molecular Environmental Science Group, Building 203, Room E-165 MRCAT, Sector 10, Advanced Photon Source, Building 433, Room B007 Argonne National Laboratory phone and voice mail: (1) 630 252 5033 Argonne IL 60439, USA fax: (1) 630 252 9793 My homepage: http://cars9.uchicago.edu/~ravel EXAFS software: http://cars9.uchicago.edu/~ravel/software/exafs/
Hi folks, I have installed the most recent dmg for OS X 10.4 (horae 062) and I am trying to run feff6 on some data. I get the following error. Any ideas? COnsider that I get the same error both by running quick first shell theory and running a feff calculation using a file.inp approach. Stefano -- ____________________________________________ Stefano Ciurli Professor of Chemistry Laboratory of Bioinorganic Chemistry Department of Agro-Environmental Science and Technology University of Bologna Viale Giuseppe Fanin, 40 I-40127 Bologna Italy Phone: +39-051-209-6204 Fax: +39-051-209-6203 "Fatti non foste a viver come bruti, ma per seguir virtute e canoscenza" Dante Alighieri - Inferno - Canto XXVI "Ihr seid bestimmt, nicht Tieren gleich zu leben, Nein, Tugend zu erringen und Erkenntnis" "Ye were not form'd to live the life of brutes, But virtue to pursue and knowledge high"
participants (2)
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Bruce Ravel -
Stefano Ciurli