Crystal structure analysis of polyethylene with electron diffraction intensity data: Deconvolution of multiple scattering effects

Polymer ◽  
1983 ◽  
Vol 24 (3) ◽  
pp. 291-294 ◽  
Author(s):  
Douglas L. Dorset ◽  
Barbara Moss
2012 ◽  
Vol 68 (2) ◽  
pp. 171-181 ◽  
Author(s):  
Tatiana E. Gorelik ◽  
Jacco van de Streek ◽  
Andreas F. M. Kilbinger ◽  
Gunther Brunklaus ◽  
Ute Kolb

Ab-initio crystal structure analysis of organic materials from electron diffraction data is presented. The data were collected using the automated electron diffraction tomography (ADT) technique. The structure solution and refinement route is first validated on the basis of the known crystal structure of tri-p-benzamide. The same procedure is then applied to solve the previously unknown crystal structure of tetra-p-benzamide. In the crystal structure of tetra-p-benzamide, an unusual hydrogen-bonding scheme is realised; the hydrogen-bonding scheme is, however, in perfect agreement with solid-state NMR data.


Author(s):  
Douglas L. Dorset

AbstractThe prospect of carrying out quantitative crystal structure analyses by direct methods with electron diffraction intensity data from zeolites is evaluated for two related materials: ZSM-5 and ZSM-11. The stacked plate-like arrays of ZSM-5 induce intensity perturbations from secondary electron scattering; nevertheless, the T-site positions can be found by direct methods. Intensity data from smaller ZSM-11 microcrystals are more favorable for


Author(s):  
D. L. Dorset

AbstractThe three-dimensional crystal structure of a commercial paraffin wax has been determined from electron diffraction intensity data collected from epitaxially oriented samples. The orthorhombic space group is


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