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Crystal Structure Refinement >> Content Detail



Assignments



Assignments


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Numbers in the assignments column refer to chapters or sections in:

Amazon logo Müller, P. Crystal Structure Refinement. 1st ed. New York, NY: Oxford University Press, 2006. ISBN: 9780198570769.

The table below provides information on the assigned readings for each lecture (L) and lab (Lab) session.


SES #TOPICSASSIGNMENTS
L3

Refinement with SHELXL

Hydrogen atoms

1, 2, and 3
Lab3Hydrogen atoms (cont.)3.5.1, 3.5.2, and 3.5.3
L4Atom type assignment4
Lab4Atom type ambiguities4.4.1, 4.4.2, and 4.4.3
L5Disorder5
Lab5Refinement of disorder on not so difficult examples5.3.1, 5.3.3, and 5.3.4
L6More on disorder5
Lab6Refinement of a difficult disordered structure5.3.2 or 5.3.5
L7Pseudo symmetry6
Lab7Pseudo symmetry (cont.)6.3.1, 6.3.2
L8Twinning7
Lab8Refinement of merohedral and pseudo-merohedral twins7.8.1, 7.8.2
L9

More on twinning

CELL_NOW and TWINABS

7
Lab9Refinement of non-merohedral twins7.8.5 and 7.8.6
L10Artefacts8
L11Structure validation using PLATON9
Lab10Using PLATON on our structures8.3.1

 








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