Pinned Loading
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FEFF_spectra
FEFF_spectra PublicC++ code to perform post-processing on the simulated X-ray spectra generated by FEFF code.
C++
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OCEAN_workflow
OCEAN_workflow PublicA collection of C++ and Python codes that provide an automated workflow for high-throughput X-ray spectra calculation and post-processing, interfacing Materials Project database and OCEAN code.
Python
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