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- Cspace_group.html
- ... ms]' Definition: The SPACE_GROUP category introduced in the symmetry CIF dictionary (cif_sym.dic) is intended to replace the original core SYMMETRY category. ... ...
Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_ms.dic/Cspace_group.html
- Cspace_group.html
- ... in this dictionary. The remainder are found in the symmetry CIF dictionary. Space-group types are identified by their number as ... for the Hermann-Mauguin symbol are found in the symmetry CIF dictionary. Example: Example 1 - the monoclinic space group No. 15 ... ...
Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/2/cif_mm.dic/Cspace_group.html
- Cpd_meas.html
- ... correction terms. While additional information may be added to the CIF as data are processed and transported between laboratories (possibly with ... block_id entry), the information in this section of the CIF will rarely be changed once data collection is complete. Where ... ...
Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_pd.dic/Cpd_meas.html
- Icell_subsystem_matrix_W_.html
- ... the appropriate W matrices. In any case (single or multiblock CIF), the values assigned to the items describing the atomic parameters ... Such a basis will be explicitly given in a multiblock CIF or should be calculated (with the appropriate W matrix) in ... ...
Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_ms.dic/Icell_subsystem_matrix_W_.html
- Caudit_link.html
- ... block_[pd] and _pd_block_id in the dictionary extension cif_pd.dic (http://www.iucr.org/cif/pd/index.html). Examples: Example 1 - example file for the ... ...
Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_ms.dic/Caudit_link.html
- Cspace_group_symop.html
- ... Definition: The SPACE_GROUP_SYMOP category introduced in the symmetry CIF dictionary (cif_sym.dic) is intended to replace the original core SYMMETRY_EQUIV ... ...
Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_ms.dic/Cspace_group_symop.html
- Cdatabase_2.html
- ... category name DATABASE was already in use in the core CIF dictionary, but was used differently from the way it needed to be used in the mmCIF dictionary. Since CIF data names cannot be changed once they have been adopted ... ...
Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/2/cif_mm.dic/Cdatabase_2.html
- Cspace_group.html
- ... the core dictionary. The remainder are found in the symmetry CIF dictionary. Space-group types are identified by their number as ... for the Hermann-Mauguin symbol are found in the symmetry CIF dictionary. Example: Example 1 - the monoclinic space group No. 15 ... ...
Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_core.dic/Cspace_group.html
- Cjournal.html
- ... the book-keeping by the journal staff when processing a CIF submitted for publication. The creator of a CIF will not normally specify these data items. The data names ... ...
Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_core.dic/Cjournal.html
- Caudit_link.html
- ... details about the relationships between data blocks in the current CIF. Examples: Example 1 - multiple structure paper, as illustrated in A Guide to CIF for Authors (1995). IUCr: Chester. loop_ _audit_link_block ... ...
Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_core.dic/Caudit_link.html
- Centity.html
- ... non-polymer entities. The ENTITY category is specific to macromolecular CIF applications and replaces the function of the CHEMICAL category in the CIF core. It is important to remember that the ENTITY data ... ...
Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/2/cif_mm.dic/Centity.html
- Ireflns.Friedel_coverage.html
- ... coverage. Type: float Mandatory item: no Alias: _reflns_Friedel_coverage (cif_core.dic version 2.3) The permitted range is [0.0, 1.0] Category ... ...
Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/2/cif_mm.dic/Ireflns.Friedel_coverage.html
- Irefln.include_status.html
- ... factors. Type: code Mandatory item: no Alias: _refln_include_status (cif_core.dic version 2.3) Related item: _refln.status (alternate) The data value ... ...
Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/2/cif_mm.dic/Irefln.include_status.html
- Irefln.d_spacing.html
- ... . Type: float Mandatory item: no Alias: _refln_d_spacing (cif_core.dic version 2.3) The permitted range is [0.0, infinity) Category ... ...
Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/2/cif_mm.dic/Irefln.d_spacing.html
- Irefln.class_code.html
- ... lattice. Type: code Mandatory item: no Alias: _refln_class_code (cif_core.dic version 2.3) Category: refln...
Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/2/cif_mm.dic/Irefln.class_code.html
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