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README.md
README.md
 
 
nnxanes_utils.py
nnxanes_utils.py
 
 
xyz_to_FEFF.py
xyz_to_FEFF.py
 
 

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xafsutil

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Utility scripts for XAFS/XANES workflows, including NN-XANES helpers and XYZ-to-FEFF conversion.

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python spectroscopy x-ray-absorption-spectroscopy feff xafs xas xanes

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