International
Tables for
Crystallography
Volume G
Definition and exchange of crystallographic data
Edited by J. R. Hester and B. McMahon

International Tables for Crystallography (2026). Vol. G. Early view chapter
https://doi.org/10.1107/97809553602060001011

Chapter 4.2 Core dictionary (coreCIF)


Index

Core dictionary version 3.3.0

_atom_analytical.chemical_species_mass_percent

Name:
_atom_analytical.chemical_species_mass_percent

Definition:

   
    Mass percentage of the chemical species given in
    _atom_analytical.chemical_species as derived from elemental analysis.

    This is most often used in elemental compositions determined by
    X-ray fluorescence, where elements are reported as equivalent mass
    percentages of their relevant oxide. For example: Al is reported
    as Al2O3, P is reported as P2O5.

Type: Real

Units: none


The permitted range is 0.0 → 100.0

Category:
atom_analytical








































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