This is item 5i in the Google doc. Data owner is Yiming.
Data comprises.TM K-edge (from Yiming), TM-L edge, O K-edge (from Haili).
There are two kinds of data here:
the simulated structure (chi file)
the simulated spectrum
For a given simulated structure, there may be multiple simulated spectra; that is, there is a one-to-many relationship between structure and spectra. We can encode this association in the metadataof each spectrum:{"structure": <uid of structure>}. Later, this would be an ideal use case for references but we don't have that feature availabe in aimmdb yet.
This is item 5i in the Google doc. Data owner is Yiming.
Data comprises.TM K-edge (from Yiming), TM-L edge, O K-edge (from Haili).
There are two kinds of data here:
For a given simulated structure, there may be multiple simulated spectra; that is, there is a one-to-many relationship between structure and spectra. We can encode this association in the
metadataof each spectrum:{"structure": <uid of structure>}. Later, this would be an ideal use case forreferencesbut we don't have that feature availabe in aimmdb yet.