Publication data of Dyballa group for: "Introducing a Novel Method for Probing Accessibility, Local Environment and Spatial Distribution of Oxidative Sites on Solid Catalysts using Trimethylphosphine"

Version 1.0

Rieg, Carolin; Dittmann, Daniel; Li, Zheng; Kurtz, Alan; Kaya, Elif; Peters, Stefan; Kunkel, Benny; Parlinska-Wojtan, Magdalena; Wohlrab, Sebastian; Abdel-Mageed, Ali; Dyballa, Michael, 2022, "Publication data of Dyballa group for: "Introducing a Novel Method for Probing Accessibility, Local Environment and Spatial Distribution of Oxidative Sites on Solid Catalysts using Trimethylphosphine"", https://doi.org/10.18419/darus-2992, DaRUS, V1

Learn about Data Citation Standards.

Contact Owner

Dataset Metrics

2,416 Downloads

Description	Primary data files of measurements and processed data of the journal article mentioned under related publications from Dyballa group can be found here. This comprises MAS-NMR, ICP-OES, N2-Physisorption (Brunauer-Emmett-Teller method; BET), XRD, and STEM data. The STEM images are stored in the folder "STEM". (2022-07-12)
Subject	Chemistry
Keyword	Zeolite
Related Publication	Rieg, Carolin; Dittmann, Daniel; Li, Zheng; Kurtz, Alan; Kaya, Elif; Peters, Stefan; Kunkel, Benny; Parlinska-Wojtan, Magdalena; Wohlrab, Sebastian; Abdel-Mageed, Ali; Dyballa, Michaell. Introducing a Novel Method for Probing Accessibility, Local Environment and Spatial Distribution of Oxidative Sites on Solid Catalysts using Trimethylphosphine. Journal of Physical Chemistry C 2022, 126, 13213-13223 doi: 10.1021/acs.jpcc.2c04114
Data Generation	Analysis; Experiment
License/Data Use Agreement	CC BY 4.0

Change View

Table

Tree

Filter by

	1 to 10 of 53 Files	Download
	BET_A200.pdf BET/Adobe PDF - 266.5 KB Published Aug 27, 2022 33 Downloads MD5: fc2fd8dbf5fe0f4d21b72a13b1e960ec	Preview "BET/BET_A200.pdf" Access File File Access Public Download Options Adobe PDF Download Metadata Data File Citation EndNote XML RIS BibTeX
	BET_H-MCM-22.pdf BET/Adobe PDF - 264.0 KB Published Aug 27, 2022 20 Downloads MD5: 4e23248e172176969a593fbc39625dd6	Preview "BET/BET_H-MCM-22.pdf" Access File File Access Public Download Options Adobe PDF Download Metadata Data File Citation EndNote XML RIS BibTeX
	BET_H-ZSM-5.pdf BET/Adobe PDF - 266.4 KB Published Aug 27, 2022 18 Downloads MD5: 9501cc64a2ce2d20765da06095818f2b	Preview "BET/BET_H-ZSM-5.pdf" Access File File Access Public Download Options Adobe PDF Download Metadata Data File Citation EndNote XML RIS BibTeX
	BET_Na-ZSM-5.pdf BET/Adobe PDF - 266.1 KB Published Aug 27, 2022 18 Downloads MD5: da13f2b86602a0cc36da8e3caf3dcbd0	Preview "BET/BET_Na-ZSM-5.pdf" Access File File Access Public Download Options Adobe PDF Download Metadata Data File Citation EndNote XML RIS BibTeX
	BET_SBA-15.pdf BET/Adobe PDF - 278.1 KB Published Aug 27, 2022 49 Downloads MD5: 79bdf234c2b18f35bf51b39a48cbc4c6	Preview "BET/BET_SBA-15.pdf" Access File File Access Public Download Options Adobe PDF Download Metadata Data File Citation EndNote XML RIS BibTeX
	CR03022022-Si-Cu-Mn-Co-r.xlsx ICP-OES/MS Excel Spreadsheet - 9.9 KB Published Aug 27, 2022 47 Downloads MD5: 8031eb9fb3b694c9e00dd0c5e2f0eaa9	Access File File Access Public Download Options MS Excel Spreadsheet Download Metadata Data File Citation EndNote XML RIS BibTeX
	CR05102021-Si-Mo-r.xlsx ICP-OES/MS Excel Spreadsheet - 14.0 KB Published Aug 27, 2022 51 Downloads MD5: b8269d1d227fbb6f493fcf53645a2e65	Access File File Access Public Download Options MS Excel Spreadsheet Download Metadata Data File Citation EndNote XML RIS BibTeX
	CR09122021-Si-Mo-r.xlsx ICP-OES/MS Excel Spreadsheet - 14.1 KB Published Aug 27, 2022 40 Downloads MD5: 5728b38875025a06db43291e0d005661	Access File File Access Public Download Options MS Excel Spreadsheet Download Metadata Data File Citation EndNote XML RIS BibTeX
	CR10112021-Si-Mo-r.xlsx ICP-OES/MS Excel Spreadsheet - 13.2 KB Published Aug 27, 2022 36 Downloads MD5: 176ee779d2b924a1c953d5fb099a9018	Access File File Access Public Download Options MS Excel Spreadsheet Download Metadata Data File Citation EndNote XML RIS BibTeX
	CR25112021-Si-Mo-r.xlsx ICP-OES/MS Excel Spreadsheet - 14.4 KB Published Aug 27, 2022 45 Downloads MD5: 1c62b827aeb008614765f7f756772830	Access File File Access Public Download Options MS Excel Spreadsheet Download Metadata Data File Citation EndNote XML RIS BibTeX

Citation Metadata

Persistent Identifier	doi:10.18419/darus-2992
Publication Date	2022-08-27
Title	Publication data of Dyballa group for: "Introducing a Novel Method for Probing Accessibility, Local Environment and Spatial Distribution of Oxidative Sites on Solid Catalysts using Trimethylphosphine"
Author	Rieg, Carolin (University of Stuttgart) - ORCID: 0000-0002-7299-3414 Dittmann, Daniel (University of Stuttgart) - ORCID: 0000-0001-9110-0688 Li, Zheng (University of Stuttgart) Kurtz, Alan (University of Stuttgart) - ORCID: 0000-0003-3186-9959 Kaya, Elif (University of Stuttgart) Peters, Stefan (Leibniz Institute for Catalysis) Kunkel, Benny (Leibniz Institute for Catalysis) Parlinska-Wojtan, Magdalena (Institute of Nuclear Physics, Polish Academy of Sciences) - ORCID: 0000-0001-5901-400X Wohlrab, Sebastian (Leibniz Institute for Catalysis) - ORCID: 0000-0003-1407-7263 Abdel-Mageed, Ali (Leibniz Institute for Catalysis) - ORCID: 0000-0003-4160-0611 Dyballa, Michael (University of Stuttgart) - ORCID: 0000-0002-8883-1145
Point of Contact	Use email button above to contact. Dyballa, Michael (University of Stuttgart) Abdel-Mageed, Ali (Leibniz Institute for Catalysis)
Description	Primary data files of measurements and processed data of the journal article mentioned under related publications from Dyballa group can be found here. This comprises MAS-NMR, ICP-OES, N2-Physisorption (Brunauer-Emmett-Teller method; BET), XRD, and STEM data. The STEM images are stored in the folder "STEM". (2022-07-12)
Subject	Chemistry
Keyword	Zeolite http://data.loterre.fr/ark:/67375/37T-SP7VGHG0-Z (Loterre Chemistry Vocabulary)
Topic Classification	Physical Chemistry (Loterre Chemistry Vocabulary) http://data.loterre.fr/ark:/67375/37T-BJ2L28P4-W
Related Publication	Rieg, Carolin; Dittmann, Daniel; Li, Zheng; Kurtz, Alan; Kaya, Elif; Peters, Stefan; Kunkel, Benny; Parlinska-Wojtan, Magdalena; Wohlrab, Sebastian; Abdel-Mageed, Ali; Dyballa, Michaell. Introducing a Novel Method for Probing Accessibility, Local Environment and Spatial Distribution of Oxidative Sites on Solid Catalysts using Trimethylphosphine. Journal of Physical Chemistry C 2022, 126, 13213-13223 doi: 10.1021/acs.jpcc.2c04114 https://doi.org/10.1021/acs.jpcc.2c04114
Language	English
Contributor	Research Group : Dittmann, Daniel Project Member : Zheng, Li Research Group : Kaya, Elif Related Person : Kurtz, Alan Related Person : Peters, Stefan Related Person : Kunkel, Benny Related Person : Parlinska-Wojtan, Magdalena Related Person : Wohlrab, Sebastian Supervisor : Abdel-Mageed, Ali Supervisor : Dyballa, Michael
Funding Information	DFG: 358283783 - SFB 1333
Project	Project C1 (Level 1)
Depositor	Rieg, Carolin
Deposit Date	2022-07-12
Data Type	experimental data

Process Metadata

Processing Methods	MAS NMR spectroscopy (31P, 1H and 27Al magic angle spinning nuclear magnetic resonance spectroscopy; Phase and baseline corrections of NMR data are necessary for displaying nice NMR spectra and both corrections are performed by using TopSpin software (Bruker company) and DMFIT.) ICP-OES (inductively-coupled plasma atomic emission spectroscopy) XRD (X-ray diffraction) N2-physisorption (BET) BF/HAADF-STEM (bright field (BF) and high angle annular dark field (HAADF) scanning transmission (STEM) microscopy and corresponding EDX mappings of materials with different molybdenum contents and species.)
Software	TopSpin Version: 3.6.2 (https://www.bruker.com/en/products-and-solutions/mr/nmr-software/topspin.html) DMFIT (https://nmr.cemhti.cnrs-orleans.fr/dmfit/default.aspx) (Massiot, D., Fayon, F., Capron, M., King, I., Le Calvé, S., Alonso, B., Durand, J.-O., Bujoli, B., Gan, Z. and Hoatson, G. (2002), Modelling one- and two-dimensional solid-state NMR spectra. Magn. Reson. Chem., 40: 70-76. https://doi.org/10.1002/mrc.984)
Instruments	Bruker Bruker Avance III 400WB (for MAS-NMR) , Software: TopSpin Cs-corrected FEI Titan electron microscope (for and BF / HAADF-STEM measurements) Bruker d8 diffractometer (for XRD) Quantachrome Autosorb 3B (for N2-physisorption measurements)

Engineering Metadata

Data Generation	Analysis; Experiment
System Phases	Porous Materials (Components: A200, SBA-15, H-MCM-22, Na-ZSM-5, H-ZSM-5) Metals (Components: Ca, Pd, Pt, Ru, Cu, Mn, Co, Mo) Probe molecule (Components: TMP)
System or Phase Components	A200 (Aerosil® 200 is a hydrophilic fumed silica with a specific surface area of 200 m²/g.) SBA-15 (Santa Barbara Amorphous type material) H-ZSM-5 (Proton-exchanged form of Zeolite Socony Mobil-5, an aluminosilicate zeolite belonging to the pentasil family of zeolites.) Na-ZSM-5 (Sodium-exchanged form of Zeolite Socony Mobil-5, an aluminosilicate zeolite belonging to the pentasil family of zeolites.) H-MCM-22 (Proton-exchanged form of Zeolite MCM-22 (Mobil Composition Materials)) Ca (calcium) Pd (palladium) Pt (platinum) Ru (ruthenium) Cu (copper) Mn (manganese) Co (cobalt) Mo (molybdenum) TMP (trimethylphosphine) (InChICode: 1S/C3H9P/c1-4(2)3/h1-3H3) (SmilesCode: CP(C)C) TEOS (tetraethylorthosilicate) (InChICode: 1S/C8H20O4Si/c1-5-9-13(10-6-2,11-7-3)12-8-4/h5-8H2,1-4H3) (IUPAC Name: tetraethoxysilane)

Dataset Terms

License/Data Use Agreement

Our Community Norms as well as good scientific practices expect that proper credit is given via citation. Please use the data citation shown on the dataset page.

Creative Commons Attribution 4.0 International License. CC BY 4.0

Dataset Version	Summary	Contributors	Published on
No records found.

Edit File

This file has already been deleted (or replaced) in the current version. It may not be edited.

Restrict Access

Restricting limits access to published files. People who want to use the restricted files can request access by default. If you disable request access, you must add information about access to the Terms of Access field.

Learn about restricting files and dataset access in the User Guide.

Request Access

Enable access request

You must enable request access or add terms of access to restrict file access.

Terms of Access for Restricted Files

Save Changes

Edit Embargo

The selected file or files have already been published. Contact an administrator to change the embargo date or reason of the file or files.

Edit Retention Period

The selected file or files have already been published. Contact an administrator to change the retention period date or reason of the file or files.

Delete Files

The file will be deleted after you click on the Delete button.

Files will not be removed from previously published versions of the dataset.

Select File(s)

Please select one or more files.

Share Dataset

Share this dataset on your favorite social media networks.

Continue

Dataset Citations

Citations for this dataset are retrieved from Crossref via DataCite using Make Data Count standards. For more information about dataset metrics, please refer to the User Guide.

Sorry, no citations were found.

Inaccessible Files Selected

The selected file(s) may not be downloaded because you have not been granted access or the file(s) have a retention period that has expired or the files can only be transferred via Globus.

Ineligible Files Selected

The selected file(s) may not be transferred because you have not been granted access or the file(s) have a retention period that has expired or the files are not Globus accessible.

Download Options

The files selected are too large to download as a ZIP.

You can select individual files that are below the 1.9 GB download limit from the files table, or use the Data Access API for programmatic access to the files.

Select File(s)

Please select a file or files to be downloaded.

Inaccessible Files Selected

The selected file(s) may not be downloaded because you have not been granted access or the file(s) have a retention period that has expired.

Click Continue to download the files you have access to download.

Ineligible Files Selected

Some file(s) cannot be transferred. (They are restricted, embargoed, with an expired retention period, or not Globus accessible.)

Click Continue to transfer the elligible files.

Delete Dataset

Are you sure you want to delete this dataset and all of its files? You cannot undelete this dataset.

Delete Draft Version

Are you sure you want to delete this draft version? Files will be reverted to the most recently published version. You cannot undelete this draft.

Unpublished Dataset Private URL

Private URL can only be used with unpublished versions of datasets.

Unpublished Dataset Private URL

Are you sure you want to disable the Private URL? If you have shared the Private URL with others they will no longer be able to use it to access your unpublished dataset.

Delete Files

The file(s) will be deleted after you click on the Delete button.

Files will not be removed from previously published versions of the dataset.

Compute

This dataset contains restricted files you may not compute on because you have not been granted access.

Deaccession Dataset

Are you sure you want to deaccession? This is permanent and the selected version(s) will no longer be viewable by the public.

Deaccession Dataset

Are you sure you want to deaccession this dataset? This is permanent an it will no longer be viewable by the public.

Version Differences Details

Please select two versions to view the differences.

Version Differences Details

Version:
Last Updated:

Select File(s)

Please select a file or files for access request.

Select File(s)

Embargoed files cannot be accessed. Please select an unembargoed file or files for your access request.

Edit Tags

Select existing file tags or create new tags to describe your files. Each file can have more than one tag.

Request Access

You need to Log In to request access.

Dataset Terms

Please confirm and/or complete the information needed below in order to request access to files in this dataset.

This dataset is made available under the following terms. Please confirm and/or complete the information needed below in order to continue.

License/Data Use Agreement

Our Community Norms as well as good scientific practices expect that proper credit is given via citation. Please use the data citation shown on the dataset page.

Creative Commons Attribution 4.0 International License. CC BY 4.0

Preview Guestbook

Upon downloading files the guestbook asks for the following information.

Guestbook Name

Collected Data

Account Information

Package File Download

Use the Download URL in a Wget command or a download manager to download this package file. Download via web browser is not recommended. User Guide - Downloading a Dataverse Package via URL

Download URL

https://darus.uni-stuttgart.de/api/access/datafile/

Compute Batch

Clear Batch

Dataset	Persistent Identifier	Change Compute Batch

Compute Batch

Submit for Review

Please use the publication checklist for authors ( https://www.izus.uni-stuttgart.de/en/fokus/darus/publication/ ) to ensure publication readiness. You will not be able to make changes to this dataset while it is in review.

Publish Dataset

Are you sure you want to republish this dataset?

Select if this is a minor or major version update.

Minor Release (1.1)

Major Release (2.0)

Publish Dataset

This dataset cannot be published until SFB 1333 C1 - Dyballa group, ITC is published by its administrator.

Publish Dataset

This dataset cannot be published until SFB 1333 C1 - Dyballa group, ITC and SFB 1333 "Molecular heterogeneous catalysis in confined geometries" are published.

Return to Author

Return this dataset to contributor for modification. The reason for return entered below will be sent by email to the author.