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Figure 12
Comparison of powder patterns of γ-QA: (a) experimental powder pattern, (b) calculated from experimental structure QNACRD04, (c) calculated from QNACRD04 after minimization in the force field, (d) calculated from structure 2, (e) calculated from structure 2 after Rietveld refinement (peak profiles not fitted for clarity).

Journal logoJOURNAL OF
APPLIED
CRYSTALLOGRAPHY
ISSN: 1600-5767
Volume 40| Part 1| January 2007| Pages 105-114
doi:10.1107/S0021889806043767
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