All data in the COD and the database itself are dedicated to the public domain and licensed under the CC0 License.Users of the data should acknowledge the original authors of the structural data.

A small team of engaged scientists with some experience in database and software design coordinate the Crystallography Open Database (COD) project based on free and automated software a) for maintaining the database, b) for data evaluation and calculation of derived data (e.g. calculated powder pattern from crystal structures for search-match ...

All data in the COD and the database itself are dedicated to the public domain and licensed under the CC0 License.Users of the data should acknowledge the original authors of the structural data.

COD ID Links Formula Space group Cell parameters Cell volume Bibliography; 1000001: CIF: C107 H142 N14 O26: P 21 21 21: 48.48; 21.72; 10.74 90; 90; 90: 11309.1 ...

Apr 22, 2021 · http://www.crystallography.net/pcod/cif/ There is currently no pre-packed version of PCOD (.zip or .tgz files), but if you would need one, please let me know, I will make one and publish it on the Web.

Jan 13, 2008 · Mineral name: Magnetite: Formula: Fe3 O4: Calculated formula: Fe3 O4: SMILES [Fe+3].[Fe+3].[Fe+2].[O-2].[O-2].[O-2].[O-2] Title of publication: Crystal structures and cation distributions in simple spinels from powder XRD structural refinements: MgCr2O4, ZnCr2O4, Fe3O4 and the temperature dependence of the cation distribution in ZnAl2O4 Sample: Fe3O4, …

Apr 25, 2023 · svn log svn://www.crystallography.net/cod/cif/2/00/29/2002926.cif. The subdirectories under the cif/ tree are constructed using the first, the second-third and the fourth-fifth digits of the COD ID. For automatic parsing of the COD logs, XML format is recommended: svn log --xml svn://www.crystallography.net/cod/cif/2/00/29/2002926.cif

You may also directly ask the database by sending requests like: http://www.crystallography.net/cod/result.php?text1=heulandite . Selecting elements (up to 8), allows for an inclusive search (compounds with other elements are not excluded).

About the Validation and Deposition Interface. This interface allows you to upload, validate, edit and deposit CIF files. Steps. The process of file deposition is pretty straightforward:

Revision Date Message Files; 130149 (current) 2015-01-27: cod/ (saulius@kolibris) Deriving Hall space group symbols for 12003 CIFs using the 'cif_filter --estimate-spacegroup' command.