COMCIFS TopoCif issues - Githubissues

COMCIFS / TopoCif

Development of the Topology CIF Dictionary

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Rename dictionary and head category

#82 vaitkus opened 4 months ago
0
Update CIF_CORE import statement

#81 vaitkus closed 4 months ago
0
ITG2e: after author proof corrections

#80 nautolycus opened 7 months ago
0
Fix GitHub actions

#79 vaitkus closed 7 months ago
0
Remove remarks on dictionary being a draft

#78 vaitkus closed 7 months ago
0
Update readme

#77 vaitkus closed 7 months ago
0
Placeholder example values in the `TOPOL` category

#76 vaitkus opened 7 months ago
2
Add the _type.dimension attribute to the definition of _topol_node.coordination_sequence

#75 vaitkus closed 10 months ago
0
Change the _type.source attribute of all SU data items to 'Related'.

#74 vaitkus closed 1 year ago
0
Remove an extra data header.

#73 vaitkus closed 1 year ago
0
Rename the default branch from 'master' to 'main'

#72 vaitkus closed 1 year ago
4
Update items to be compatible with linked items

#71 vaitkus closed 2 years ago
0
README needs updating

#70 jamesrhester opened 2 years ago
0
Add enumeration defaults

#69 vaitkus closed 2 years ago
0
Add lower enumeration ranges to several data items

#68 vaitkus opened 2 years ago
2
core dic definition for _space_group.name_Hall missing something

#67 BobHanson closed 2 years ago
1
Declare the TOPOL_TILING category as looped

#66 vaitkus closed 2 years ago
0
Remove rejected items

#65 vaitkus closed 2 years ago
0
Add the _dictionary.namespace attribute

#64 vaitkus closed 2 years ago
0
Add multiple standard uncertainty (SU) data items

#63 vaitkus closed 2 years ago
0
Add the _dictionary.uri attribute

#62 vaitkus closed 2 years ago
0
Mandatory `_dictionary.namespace` attribute is missing

#61 vaitkus closed 2 years ago
2
Add 'none' as the measurement units to of multiple data items

#60 vaitkus closed 2 years ago
0
Homogenise several more data item names in the dictionary examples

#59 vaitkus closed 2 years ago
0
Redefine Wyckoff symbol as enumeration set

#58 vaitkus closed 3 years ago
0
Homogenise dictionary version numbers to the SemVer 2.0.0 format

#57 vaitkus closed 3 years ago
1
Update data name capitalisation

#56 vaitkus closed 3 years ago
1
Redefined the _topol_net.period data item as an enumeration set

#55 vaitkus closed 3 years ago
0
Add enumeration range to the _topol_tiling.D_size data item

#54 vaitkus closed 3 years ago
0
Add a lower enumeration range to _topol_tiling.D_size

#53 vaitkus closed 3 years ago
2
Correct several data name typos in examples

#52 vaitkus closed 3 years ago
0
Rename several data items

#51 vaitkus closed 3 years ago
0
Add reference DOI

#50 vaitkus closed 3 years ago
0
Update the capitalisation of certain data names

#49 vaitkus closed 3 years ago
1
Fix minor style issues

#48 vaitkus closed 3 years ago
0
Slightly rename several data items

#47 vaitkus closed 3 years ago
6
Data item `_topol_node.wyckoff_symbol` should be redefined as an enumeration set

#46 vaitkus closed 3 years ago
1
Rename _topol_net.overall_topology_rscr to _topol_net.overall_topology_RCSR

#45 vaitkus closed 3 years ago
0
Add an enumeration range to count data items

#44 vaitkus closed 3 years ago
0
Rename symop_id data items

#43 vaitkus closed 3 years ago
1
Data item _topol_net.period might be better defined as an enumeration set

#42 vaitkus closed 3 years ago
4
Naming and description of the *.symop data items

#41 vaitkus closed 3 years ago
4
Description of the _topol_tiling.signature data item does not match the provided examples

#40 vaitkus closed 2 years ago
1
Fix syntax problems in CIF files

#39 vaitkus closed 3 years ago
5
Correct definitions of the _topol_node.fract_* data items

#38 vaitkus closed 3 years ago
0
Data items _topol_node.fract_* should not be linked to the _atom_site.label data item

#37 vaitkus opened 3 years ago
13
Correct several data names in the data item and category descriptions

#36 vaitkus closed 3 years ago
1
Data item _topol_link.site_symmetry_symop_id mentioned, but not defined

#35 vaitkus closed 3 years ago
2
Standardise save frame names

#34 vaitkus closed 3 years ago
4
Update TopologyCIF_0.9.2.dic

#33 Blatov closed 3 years ago
7