Dataset

Zeo-1_SD_2022



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Name Zeo-1_SD_2022
Extended ID Zeo-1_SD_2022_KomissarovVerstraelen__DS_9in0wrvt6qg2_0
Description 130,000 configurations of zeolite from the Database of Zeolite Structures. Calculations performed using Amsterdam Modeling Suite software.
Authors Leonid Komissarov
Toon Verstraelen
Elements O (65.32%)
Si (31.16%)
Al (0.4%)
H (1.97%)
N (0.06%)
C (0.06%)
Ge (0.69%)
F (0.01%)
Ca (0.07%)
Li (0.01%)
Na (0.12%)
Be (0.02%)
Ba (0.01%)
Cs (0.02%)
K (0.09%)
Number of Data Objects 12,930
Number of Configurations 12,930
Number of Atoms 1,841,742
Links https://doi.org/10.24435/materialscloud:cv-zd
https://doi.org/10.1038/s41597-022-01160-5
Configuration Sets by Name (None)
Configuration Sets by ID (None)
Data Objects Too many to display
ColabFit ID DS_9in0wrvt6qg2_0
Files colabfitspec.json

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