Published February 27, 2023
| Version 1.0.0
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Penta-coordinated or -valent: the nature of the chemical bond of some Ti-C-Al compounds
Description
These folders contain the raw date which were used to prepare the above publication.
The zipfiles entitles compound-1.zip, compound-2.zip, and compound-3.zip contain the data for the computed compounds of the main publication. Please refer to that for further details. The zip-file xray.zip contains the original cif-file for convenience.
Files
al2me3.zip
Files
(4.3 GB)
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md5:5d3917f5e9e1a75232b45ce80bf73003
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169.7 MB | Preview Download |
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md5:3bd40dd45188a12ae4bf1b33030c759a
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1.4 GB | Preview Download |
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md5:351c039dab212b99232a54b84fc5abf5
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1.3 GB | Preview Download |
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md5:5318a1840d8296113b4b1fd9a390a069
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1.4 GB | Preview Download |
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md5:dd9b2b16af35efe3f0196a7873539339
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4.4 kB | Preview Download |
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md5:a08c89ff6adc526b05c245b67a8b4bf6
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31.2 kB | Preview Download |
Additional details
Related works
- Is supplement to
- Journal article: 10.1039/D3DT00164D (DOI)