Metrics
0 Downloads
Share Dataset

Share this dataset on your favorite social media networks.

Confinement-tuned magnetic competition and spin-asymmetric transport in quasi-one-dimensional NiCl2 confined within carbon nanotubes

Version 1.0

Saeed, Waqas; Fidler, Aleksandra; Dłużewski, Piotr; Sloan, Jeremy; Kaleta, Anna; R. Lees, Martin; I. Hiley, Craig; Kret, Slawomir, 2026, "Confinement-tuned magnetic competition and spin-asymmetric transport in quasi-one-dimensional NiCl2 confined within carbon nanotubes", https://doi.org/10.18150/QSM9KP, RepOD, V1

Learn about Data Citation Standards.

Description

This dataset contains the experimental and computational data associated with the article “Confinement-tuned magnetic competition and spin-asymmetric transport in quasi-one-dimensional NiCl₂ confined within carbon nanotubes”, published in Carbon.

The dataset includes high-resolution STEM/EDS characterization data of NiCl₂ encapsulated within single-walled carbon nanotubes (SWCNTs), along with supporting experimental observations of structural configurations and filling behavior. In addition, it provides results from spin-polarized density functional theory (DFT+U) calculations, including electronic structure data such as projected density of states (PDOS), band structures, charge density distributions, COHP analysis, and transport-related quantities derived from velocity-weighted metrics and BoltzTraP2 simulations.

The data support the investigation of confinement-induced modifications in magnetic ordering and spin-dependent transport properties of quasi-one-dimensional NiCl₂ fragments inside carbon nanotubes, including the competition between ferromagnetic and antiferromagnetic states and the emergence of spin-asymmetric transport behavior.

All figures and tables presented in the publication are included in reproducible formats, together with underlying numerical data where applicable. This dataset is provided to ensure transparency, reproducibility, and further reuse in studies of low-dimensional magnetism, confined halide systems, and carbon nanotube-based hybrid materials.

The associated publication is available at: https://www.sciencedirect.com/science/article/abs/pii/S0008622326002034

(2026-03-31)
Subject
Physics
Keyword

Carbon nanotubes; NiCl₂; confined metal halides; low-dimensional magnetism; spin-asymmetric transport; density functional theory (DFT+U); electronic structure; STEM

Related Publication

Saeed, W., Fidler, A., Dłuzewski, P., Sloan, J., Kaleta, A., Lees, M. R., Hiley, C. I., & Kret, S. (2026). Confinement-tuned magnetic competition and spin-asymmetric transport in quasi-one-dimensional NiCl₂ confined within carbon nanotubes. Carbon, 253, 121429. https://doi.org/10.1016/j.carbon.2026.121429 doi: 10.1016/j.carbon.2026.121429

CC BY - Creative Commons Attribution 4.0 CC BY - Creative Commons Attribution 4.0

Find
1 to 2 of 2 Files
Figures_PPScripts.zip
ZIP Archive - 16.3 MB - Apr 1, 2026 - 0 Downloads
MD5: c44ced1a3d168a854885119da7770a0f
License: CC BY - Creative Commons Attribution 4.0
Figures and Python Scripts
Download
Full_Supporting_Information.pdf
Adobe PDF - 1.7 MB - Apr 1, 2026 - 0 Downloads
MD5: 5fe9afb676d67e360970e7fcdc9e0f91
License: CC BY - Creative Commons Attribution 4.0
Preview
Download
Select File(s)

Please select a file or files to be deleted.

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.

Select File(s)

Please select a file or files to be edited.

Select File(s)

Please select a file or files to be edited.

Select File(s)

Please select a file or files to be edited.

Edit license

For selected file(s) set a license to

Select File(s)

Please select a file or files to be downloaded.

Select File(s)

Please select a file or files for access request.

Select File(s)

Please select restricted file(s) to be unrestricted.

Request Access

  You need to Log In/Sign Up to request access to this file.

Continue
Dataset Terms

Please confirm and/or complete the information needed below in order to continue.

Asterisks indicate required fields

Request Access

Access to file(s) subject to additional consent under following conditions:

Accept
Package File Download
Restricted Files Selected

The restricted file(s) selected may not be downloaded because you have not been granted access.

Restricted Files Selected

The restricted file(s) selected may not be downloaded because you have not been granted access.

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

Delete Dataset

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

Embargo

Embargo

Are you sure you want to lift the embargo?

Once you lift the embargo, you will not be able to set it again.

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.

Dataset Anonymized Private URL

Use a Anonymized Private URL to allow those without Dataverse accounts to access your dataset. For more information about the Private URL feature, please refer to the User Guide.

Private URL has not been created.

"WARNING. This dataset has at least one published version. Those who have access to the Anonymized Private URL for this dataset may be able to use its accessible metadata to look up the full, not anonymized version of this dataset.

Dataset Anonymized 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 dataset.

Dataset Private URL

Use a Private URL to allow those without Dataverse accounts to access your dataset. For more information about the Private URL feature, please refer to the User Guide.

Private URL has not been created.

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 dataset.

Submit for Review

You will not be able to make changes to this dataset while it is in review.

Submit
Publish Dataset

This dataset cannot be published until Institute of Physics, Polish Academy of Sciences is published. Would you like to publish both right now?

Once you publish this dataset it must remain published.

Publish Dataset

Are you sure you want to republish this dataset?

Select if this is a minor or major version update.

Publish Dataset

This dataset cannot be published until Institute of Physics, Polish Academy of Sciences is published by its administrator.

Publish Dataset

This dataset cannot be published until Institute of Physics, Polish Academy of Sciences and RepOD are published.

Return for modification


Send a copy of this message to the return e-mail address.
OK
Deaccession Dataset

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