International Tables for Crystallography


Syntactic utilities for CIF
Brian McMahon. International Tables for Crystallography (2026). Vol. G, ch. 5.4 [ doi:10.1107/97809553602060001027 ]

Abstract

This chapter reviews a number of standalone programs that manipulate the contents of Crystallographic Information Files at the syntactic level. They neither attempt to make any crystallographic calculation, nor do they use data definitions in CIF dictionaries to check for valid numeric ranges or permitted enumerations. They fall into a number of categories: syntax checkers, which ensure that the file contents are expressed correctly according to the CIF 1.1 or CIF 2.0 syntax models; syntax converters, which switch between the permitted syntax models or which reflow content in accordance with syntactic constraints; data extractors, which extract or re-order items within a file; and syntax highlighting utilities for visual editors, allowing interactive validation and correction of syntax errors.


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About International Tables for Crystallography

International Tables for Crystallography is the definitive resource and reference work for crystallography. The multi-volume series comprises articles and tables of data relevant to crystallographic research and to applications of crystallographic methods in all sciences concerned with the structure and properties of materials.