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qzhu2017
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XRD
X-ray diffraction calculations
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Include occupancies in structure factor term.
#16
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sayred1
closed
4 years ago
sayred1
commented
4 years ago
Per
Pymatgen XRD
, atomic occupancies are included.
qzhu2017
commented
4 years ago
Not needed
Per Pymatgen XRD, atomic occupancies are included.