[Ifeffit] fitting ReO2

[Edward L. Kunkes]

Hi everyone,


  I am trying to do a first shell fit of ReO2 – where there are 2 different Re-O distances in the first coordination shell. Does anyone have an .atoms file or structural information for this material that they would be willing to share ?  


Thank you very much for your help.


-Edward Kunkes

Research Assistant 
Department of Chemical Engineering
University of Wisconsin-Madison