Predicted and experimental crystal structures of ethyl-tert-butyl ether

Hammer, S.M.; Alig, E.; Fink, L.; Schmidt, M.U.

doi:10.1107/S0108768111001169

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

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Figure 6
Comparison of the crystal structure determined from X-ray powder data (orange) and the structure predicted by lattice-energy minimization with rank 2 (blue). (a) View direction [010]; (b) view direction [001]. This figure is in colour in the electronic version of this paper.

STRUCTURAL SCIENCE
CRYSTAL ENGINEERING
MATERIALS

ISSN: 2052-5206

Volume 67| Part 2| February 2011| Pages 155-162

doi:10.1107/S0108768111001169

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