Madhusmita,
Regarding the first question, I am not clear what the problem is. I
grabbed the crystal data for anatase from Matt's website:
http://cars9.uchicago.edu/atomsdb/TiO2-ana.inp
and imported it into Artemis. I certainly don't know what the
interatomic distances for anatase shoul
On 06/12/2014 10:07 AM, Stefanie Roese wrote:
But now I fail at getting the plots with the Energy at the x-axis and
the normailzed mu at the y-axis likle Bruce did it in his talk. Which
program was used there? Athena? And how can I get the
energy/mu-information out of my feffnnn.dat files to comp
That sounds like an interesting talk. Is it available?
mam
On 6/12/2014 7:07 AM, Stefanie Roese wrote:
Dear all,
I am performing XANES calculations for silver clusters with FEFF. Aditional to my XANES
results, I would like to get information about the participating scattering paths and
Dear all,
I am performing XANES calculations for silver clusters with FEFF.
Aditional to my XANES results, I would like to get information about the
participating scattering paths and how they influence my spectra. In
detail I want to get the same pictures that Bruce ravel used in his talk
"a
