Structure determination from powder data without prior indexing, using a similarity measure based on cross-correlation functions

Habermehl, S.; Mörschel, P.; Eisenbrandt, P.; Hammer, S.M.; Schmidt, M.U.

doi:10.1107/S2052520613033994

Acta Crystallographica Section B
Acta Crystallographica
Section B STRUCTURAL SCIENCE, CRYSTAL ENGINEERING AND MATERIALS

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Figure 9
Experimental X-ray powder diagram of P.Y. 14 (dots) and simulated diagrams (red lines) (a) before optimization with FIDEL, (b) after optimization with FIDEL. Experimental data are background corrected.

STRUCTURAL SCIENCE
CRYSTAL ENGINEERING
MATERIALS

ISSN: 2052-5206

Volume 70| Part 2| March 2014| Pages 347-359

doi:10.1107/S2052520613033994

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