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International
Tables for Crystallography Volume G Definition and exchange of crystallographic data Edited by J. R. Hester and B. McMahon © International Union of Crystallography 2026 |
International Tables for Crystallography (2026). Vol. G. Early view chapter
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The introductory Chapter 1.2
establishes the need for data exchange standards, and relates this to best practice for scientific data management. The history of how the International Union of Crystallography (IUCr) commissioned the CIF project to establish such standards is described in Chapter 8.1
.
Chapter 4.1
, on the management and use of CIF dictionaries, explains the significance of the data definitions that establish an interoperable ontology. If the general reader is interested in details of the concrete format that is used within crystallography both for data files and dictionaries, Section 2.1.3
is probably sufficient. If further detail on the syntax is desired, it may be found in Chapter 2.2
.
Parts 6 and 7 discuss how CIF is used to facilitate publishing of structure report papers and deposition of structures in curated crystallographic databases, respectively.