Core dictionary (coreCIF) version 2.3.1
Category PUBL_MANUSCRIPT_INCL
Name:'_publ_manuscript_incl_[]'
Definition:
Data items in the PUBL_MANUSCRIPT_INCL category allow the authors of a manuscript submitted for publication to list data names that should be added to the standard request list used by the journal printing software. Although these fields are primarily intended to identify CIF data items that the author wishes to include in a published paper, they can also be used to identify data names created so that non-CIF items can be included in the publication. Note that *_item names MUST be enclosed in single quotes.Examples:
Example 1 - directive to include a hydrogen-bonding table, including
cosmetic headings in comments.
loop_
_publ_manuscript_incl_extra_item
_publ_manuscript_incl_extra_info
_publ_manuscript_incl_extra_defn
#
# Include Hydrogen Bonding Geometry Description
# =============================================
# Name explanation standard?
# ---- ----------- ---------
'_geom_hbond_atom_site_label_D' 'H-bond donor' yes
'_geom_hbond_atom_site_label_H' 'H-bond hydrogen' yes
'_geom_hbond_atom_site_label_A' 'H-bond acceptor' yes
'_geom_hbond_distance_DH' 'H-bond D-H' yes
'_geom_hbond_distance_HA' 'H-bond H...A' yes
'_geom_hbond_distance_DA' 'H-bond D...A' yes
'_geom_hbond_angle_DHA' 'H-bond D-H...A' yes
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Example 2 - hypothetical example including both standard CIF data items
and a non-CIF quantity which the author wishes to list.
loop_
_publ_manuscript_incl_extra_item
_publ_manuscript_incl_extra_info
_publ_manuscript_incl_extra_defn
'_atom_site_symmetry_multiplicity'
'to emphasise special sites' yes
'_chemical_compound_source'
'rare material, unusual source' yes
'_reflns_d_resolution_high'
'limited data is a problem here' yes
'_crystal_magnetic_permeability'
'unusual value for this material' no
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Type: null
Category: category_overview
