Ouro will include this asset when running the route.
Gaussian full width at half maximum in degrees for peak broadening.. Must be greater than 0 and at most 2.
Named radiation wavelength used by pymatgen's XRDCalculator.
Maximum number of strongest peaks to include in the response metadata.. Must be between 0 and 50.
Minimum relative peak intensity (0-100) to keep in the summary.. Must be between 0 and 100.
Sampling interval in degrees for the broadened XY diffraction curve.. Must be greater than 0 and at most 1.
Lower and upper bounds of the simulated 2-theta window in degrees.
Generate a simulated powder XRD pattern and return an XY peak list with peak metadata.