Democratization of dynamical 3D ED: structure analysis using dynamical diffraction applied to all types of 3D electron diffraction data

2021 ◽  
Author(s):  
Lukáš Palatinus
Keyword(s):  
Electron Diffraction ◽  
Structure Analysis ◽  
Diffraction Data ◽  
Electron Diffraction Data ◽  
Dynamical Diffraction ◽  
3D Electron

scholarly journals Ab-initio crystal structure analysis and refinement approaches of oligo p-benzamides based on electron diffraction data

2012 ◽  
Vol 68 (2) ◽  
pp. 171-181 ◽  
Author(s):  
Tatiana E. Gorelik ◽  
Jacco van de Streek ◽  
Andreas F. M. Kilbinger ◽  
Gunther Brunklaus ◽  
Ute Kolb
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonding ◽  
Electron Diffraction ◽  
Ab Initio ◽  
Structure Analysis ◽  
Diffraction Data ◽  
Crystal Structure Analysis ◽  
Electron Diffraction Data ◽  
Perfect Agreement ◽  
Bonding Scheme

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.

Collecting 3D electron diffraction data by the rotation method

2010 ◽  
Vol 225 (2-3) ◽  
Author(s):  
Daliang Zhang ◽  
Peter Oleynikov ◽  
Sven Hovmöller ◽  
Xiaodong Zou
Keyword(s):  
Electron Diffraction ◽  
Diffraction Data ◽  
Electron Diffraction Data ◽  
Rotation Method ◽  
3D Electron

scholarly journals Direct‐Space Structure Determination of Covalent Organic Frameworks from 3D Electron Diffraction Data

2020 ◽  
Vol 132 (50) ◽  
pp. 22827-22833
Author(s):  
Tu Sun ◽  
Colan E. Hughes ◽  
Linshuo Guo ◽  
Lei Wei ◽  
Kenneth D. M. Harris ◽  
...  
Keyword(s):  
Electron Diffraction ◽  
Diffraction Data ◽  
Structure Determination ◽  
Space Structure ◽  
Electron Diffraction Data ◽  
Covalent Organic Frameworks ◽  
3D Electron

scholarly journals Accurate structure refinement of thin films using 3D electron diffraction data

2015 ◽  
Vol 71 (a1) ◽  
pp. s405-s405
Author(s):  
Gwladys Steciuk ◽  
Lukas Palatinus ◽  
Philippe Boullay ◽  
Adrian David ◽  
Morgane Lacotte ◽  
...  
Keyword(s):  
Thin Films ◽  
Electron Diffraction ◽  
Diffraction Data ◽  
Structure Refinement ◽  
Electron Diffraction Data ◽  
3D Electron
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