UK Catalysis Hub Data Objects

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Repository (79)
173 data objects found

Data objects
Name: Spatial Profiling of a Pd/Al2O3 Catalyst during Selective Ammonia Oxidation Date: 2021-02-03 00:00:00 UTC
Description: EXAFS fit results, MCR results, XANES whiteline analysis, and reactor temperature
DOI: Location: https://pubs.acs.org/doi/suppl/10.1021/acscatal.0c05356/suppl_file/cs0c05356_si_001.pdf
Article: Spatial Profiling of a Pd/Al2O3 Catalyst during Selective Ammonia Oxidation
Name: SUPPORTING INFORMATION Quantum Confined High Entropy Lanthanide Oxysulfide Colloidal Nanocrystals Date: 2022-10-04 00:00:00 UTC
Description: FTIR spectra of the molecular precursors and reagents, details of the calculation of the configu...
DOI: Location: https://pubs.acs.org/doi/suppl/10.1021/acs.nanolett.2c01596/suppl_file/nl2c01596_si_001.pdf
Article: Quantum Confined High-Entropy Lanthanide Oxysulfide Colloidal Nanocrystals
Name: SUPPORTING INFORMATION (SI) Enhanced H 2 O 2 P roduction via P hotocatalytic O 2 R eduction over S tructurally - Modifie d P oly(heptazine imide) Date: 2022-06-08 00:00:00 UTC
Description: Materials details; characterization information; Supporting Note 1, ATR-FTIR and Raman spectrosc...
DOI: Location: https://pubs.acs.org/doi/suppl/10.1021/acs.chemmater.2c00528/suppl_file/cm2c00528_si_001.pdf
Article: Enhanced H<sub>2</sub>O<sub>2</sub> Production via Photocatalytic O<sub>2</sub> Reduction over Structurally-Modified Poly(heptazine imide)
Name: SI: Expanding Beyond the Micropore: Active-Site Engineering in Hierarchical Architectures for Beckmann Rearrangement Date: 2015-09-29 00:00:00 UTC
Description: Related Article: Newland, Stephanie H., Sinkler, Wharton, Mezza, Thomas, Bare, Simon R., Carrave...
DOI: Location: https://pubs.acs.org/doi/suppl/10.1021/acscatal.5b01595/suppl_file/cs5b01595_si_001.pdf
Article: Expanding Beyond the Micropore: Active-Site Engineering in Hierarchical Architectures for Beckmann Rearrangement
Name: SI: Dehydrative Etherification Reactions of Glycerol with Alcohols Catalyzed by Recyclable Nanoporous Aluminosilicates: Telescoped Routes to Glyceryl Ethers Date: 2015-11-30 00:00:00 UTC
Description: Related Article: Davies, Thomas E., Kondrat, Simon A., Nowicka, Ewa, Graham, James J., Apperley,...
DOI: Location: https://pubs.acs.org/doi/suppl/10.1021/acssuschemeng.5b00894/suppl_file/sc5b00894_si_001.pdf
Article: Dehydrative Etherification Reactions of Glycerol with Alcohols Catalyzed by Recyclable Nanoporous Aluminosilicates: Telescoped Routes to Glyceryl Ethers
Name: SI for: Teaching Enzyme Catalysis Using Interactive Molecular Dynamics in Virtual Reality Date: 2019-07-23 00:00:00 UTC
Description: Related Article: Bennie, Simon J., Ranaghan, Kara E., Deeks, Helen, Goldsmith, Heather E., O’Con...
DOI: Location: https://pubs.acs.org/doi/suppl/10.1021/acs.jchemed.9b00181/suppl_file/ed9b00181_si_003.pdf
Article: Teaching Enzyme Catalysis Using Interactive Molecular Dynamics in Virtual Reality
Name: SI for: Teaching Enzyme Catalysis Using Interactive Molecular Dynamics in Virtual Reality Date: 2019-07-23 00:00:00 UTC
Description: Related Article: Bennie, Simon J., Ranaghan, Kara E., Deeks, Helen, Goldsmith, Heather E., O’Con...
DOI: Location: https://pubs.acs.org/doi/suppl/10.1021/acs.jchemed.9b00181/suppl_file/ed9b00181_si_004.docx
Article: Teaching Enzyme Catalysis Using Interactive Molecular Dynamics in Virtual Reality
Name: SI for: Following the Formation of Silver Nanoparticles Using In Situ X-ray Absorption Spectroscopy Date: 2020-06-04 00:00:00 UTC
Description: Related Article: Godfrey, Ian J., Dent, Andrew J., Parkin, Ivan P., Maenosono, Shinya, Sankar, G...
DOI: Location: https://pubs.acs.org/doi/suppl/10.1021/acsomega.0c00697/suppl_file/ao0c00697_si_001.pdf
Article: Following the Formation of Silver Nanoparticles Using In Situ X-ray Absorption Spectroscopy
Name: S1 Supporting information The Catalytic Reduction of Carbon Dioxide on the (001), (011), and (111) surfaces of TiC and ZrC: a Computational Study Date: 2022-03-13 00:00:00 UTC
Description: Activation energy for CO2 adsorption reported in this work compared to previously reported value...
DOI: Location: https://pubs.acs.org/doi/suppl/10.1021/acs.jpcc.1c10180/suppl_file/jp1c10180_si_001.pdf
Article: Catalytic Reduction of Carbon Dioxide on the (001), (011), and (111) Surfaces of TiC and ZrC: A Computational Study
Name: S1 Supporting Information Direct observation of ammonia storage in UiO-66 incorporating Cu(II) binding sites Date: 2022-05-09 00:00:00 UTC
Description: Additional experimental details, adsorption isotherms, breakthrough experiments, views of crysta...
DOI: Location: https://pubs.acs.org/doi/suppl/10.1021/jacs.2c00952/suppl_file/ja2c00952_si_001.pdf
Article: Direct Observation of Ammonia Storage in UiO-66 Incorporating Cu(II) Binding Sites
Data objects per year
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Data objects accumulated vs. per year
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Data objects per repository
Repository Data objects
https://www.ccdc.cam.ac.uk 353
https://pubs.acs.org 173
https://www.rsc.org 153
https://static-content.springer.com 92
https://ars.els-cdn.com 64
https://chemistry-europe.onlinelibrary.wiley.com 55
https://onlinelibrary.wiley.com 36
https://data.isis.stfc.ac.uk 33
https://www.rcsb.org 27
https://www.nature.com 22
Summary
Repositories 79
Average: 15.28
Maximum: 353
Minimum: 1
Groups Data objects
1-5 58
6-10 7
11-15 4
more than 20 10
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Data object groups
Group Data objects
Compressed file [zip] 14
Crystal structure [cif/pdbe] 436
Dataset 127
Document [pdf/html/docx/ppt] 589
Media File (image/video) 28
Software [app/api/service/source code] 7
xyz 6
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Recent data objects
Name Description Publised
LaMnO3 catalytic behaviour Galaxy RO Crate object containing the workflow and data with the reprodu... 2024
Catalysts in gasoline particulate filters Galaxy RO Crate object containing the workflow and data with the reprodu... 2024
Reproducing the FeS2 Example from the Demeter Tutorials These files are provided to complement the learning materials for managi... 2024
Pt3Sn nanoparticle electrocatalysts Galaxy RO Crate object containing the workflow and data with the reprodu... 2024
Pd-Al2O3 Catalyst for Ammonia Galaxy RO Crate object containing the workflow and data with the reprodu... 2024
N2O decomposition on LaMnO3 Galaxy RO Crate object containing the workflow and data with the reprodu... 2024
MoOx/Al2O3 Cyclic Operation Galaxy RO Crate object containing the workflow and data with the reprodu... 2024
Ultra-dilute Au colloids Galaxy RO Crate object containing the workflow and data with the reprodu... 2024
Diphosphine ligands in iron Galaxy RO Crate object containing the workflow and data with the reprodu... 2024
Palladium-Catalyzed CO Oxidation Galaxy RO Crate object containing the workflow and data with the reprodu... 2024

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