xraypy / feff85exafs

Feff8L: Open Source theoretical EXAFS fitting standards
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small error in calculation of mag[feff] #22

Open bruceravel opened 9 years ago

bruceravel commented 9 years ago

I see that the value of mag[feff] for any path I have checked (not many) is currently significantly different from the baseline calculation in the test suite, but only at k=0. In practice, this will have no impact on data analysis (which typically does not include k=0 in the fit and which typically uses k-weighting). However, this is a bug.