[Ifeffit] Fortran runtime error when running feff on Hydrotalcite cif

[van der Veer, Siebe]

Dear all,

I'm trying to run feff on the Hydrotalcite cif file as can be found in the
Larch Am Min CIF browser and I get the following error:


*At line 125 of file ff2chi.f (unit = 1, file = 'list.dat')Fortran runtime
error: Bad real number in item 2 of list input*

I've been able to gather that this means there is some unreadable input in
the file that is been used, but I don't know what file this is so I don't
know what the actual bad input is and what has caused it.

Any help is greatly appreciated!

Kind regards,


-- 
*Siebe van der Veer* | *PhD student*
Nanostructures of Functional Oxides | Zernike Institute for Advanced
Materials
University of Groningen | Nijenborgh 4, 9747 AG Groningen | The Netherlands
Email: s.van.der.veer at rug.nl |
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