Dataset for "Structural Linkage Unit-Dependent Catalytic Activity for CO Oxidation over Cerium Oxysulfate Cluster Assemblies"

Melix, Patrick

doi:10.5281/zenodo.6342772

Published December 2, 2021 | Version v2

Dataset Open

Dataset for "Structural Linkage Unit-Dependent Catalytic Activity for CO Oxidation over Cerium Oxysulfate Cluster Assemblies"

Melix, Patrick¹

1. Northwestern University

Dataset relating to the publication "Structural Linkage Unit-Dependent Catalytic Activity for CO Oxidation over Cerium Oxysulfate Cluster Assemblies".

Raw input and output data as well as pre- and postprocessing scripts and figures.

Files

Files (577.8 MB)

Name	Size	Download all
calculations.tar.bz2 md5:26627c215af63b3611c8bdb24155513b	520.9 MB	Download
cp2k-cutoffs.tar.bz2 md5:708f2a96790f2839e2ff573888f3d909	11.1 MB	Download
more-structure-visualizations.tar.bz2 md5:adabf637dd2e7598c8a529bd6477efcd	9.6 MB	Download
pictures.tar.bz2 md5:de67f5214456300161a57b458ead1dc0	13.1 MB	Download
structure-creation.tar.bz2 md5:cdc3d2a5ff3a2b85074bc40ddbceaa93	23.1 MB	Download

Additional details

Is supplement to: Journal article: 10.1021/acsami.2c05937 (DOI)

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DOI

Resource type

Dataset

Publisher

Zenodo

Languages

English

License: Creative Commons Attribution 4.0 International

The Creative Commons Attribution license allows re-distribution and re-use of a licensed work on the condition that the creator is appropriately credited. Read more

Technical metadata

Created: March 10, 2022
Modified: July 16, 2022

Dataset for "Structural Linkage Unit-Dependent Catalytic Activity for CO Oxidation over Cerium Oxysulfate Cluster Assemblies"

Creators

Description

Files

Files (577.8 MB)

Additional details

Related works