On Wednesday, February 20, 2013 08:26:37 AM Christopher Patridge wrote:
The think the problem is what you interpret as rmax. Rmax in artemis is the maximum value of R that you fit the data with, whereas rmax in feff is the largest distance from the center absorbing when calculating all the paths.
The reason changing the rmax in feff does remove the error is that you must change the fitting range in (D)Artemis. I think the default vaue is ~ 3 A.
That's exactly correct. I suppose the bug here is an unclear error message. I will try to come up with something that explains the problem more clearly in the next release. B -- Bruce Ravel ------------------------------------ bravel@bnl.gov National Institute of Standards and Technology Synchrotron Methods Group at NSLS --- Beamlines U7A, X24A, X23A2 Building 535A Upton NY, 11973 Homepage: http://xafs.org/BruceRavel Software: https://github.com/bruceravel
