Core dictionary (coreCIF)

Hall, Sydney R.; Allen, Frank H.; Brown, I. David; Toby, Brian H.; Hester, James R.; Vaitkus, Antanas; Rowles, Matthew R.; Bollinger, John C.; Rainer, Daniel N.; McMahon, Brian

doi:10.1107/97809553602060001011

RELATED SITES: IUCr | IUCr Journals

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)

CIF_CORE_HEAD > STRUCTURE > ATOM > ATOM_TYPE > ATOM_TYPE_SCAT

Index

Core dictionary version 3.3.0

_atom_type_scat.Gaussian_upper_limit

Name:
_atom_type_scat.Gaussian_upper_limit

Definition:

   
    The exclusive upper limit of s for which the corresponding Gaussian
    coefficients are valid.

    See also: _atom_type_scat.Gaussian_as
          _atom_type_scat.Gaussian_bs
          _atom_type_scat.Gaussian_c

Type: Real

Units: reciprocal_angstroms

Category:
atom_type_scat

International Tables for Crystallography (2026). Vol. G. Chapter 4.2
https://doi.org/10.1107/97809553602060001011