Research data supporting "Insights into the electric double-layer capacitance of two-dimensional electrically conductive metal-organic frameworks"
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Description
This data is primarily related to the synthesis and characterisation of Cu₃(HHTP)₂, and its electrochemical characterisation in symmetric electric double-layer capacitors with 1 M NEt₄BF₄ in acetonitrile electrolyte. The data provided here consists of:
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CIF Files (contains information of the CIF files used during modelling and simulations. These can also be found at: https://doi.org/10.5281/zenodo.4694845). -
Conductivity Measurement Data (contains results from the measurements used to calculate conductivity values). -
Electrochemistry Data (contains CV data from 3-electrode cells; CV, GCD, EIS, and long-term cycling stability data from composite Cu₃(HHTP)₂ EDLCs with 1 M NEt₄BF₄ in acetonitrile electrolyte; CV, GCD, and EIS data from a Cu₃(HHTP)₂ EDLCs with 1 M NEt₄BF₄ in acetonitrile electrolyte; characterisation data for a YP50F EDLC with 1 M NEt₄BF₄ in acetonitrile; and characterisation data for an acetylene black EDLC with 1 M NEt₄BF₄ in acetonitrile). -
Elemental Analysis Data (contains elemental analysis data). -
Gas Sorption Data (.xlsx, .txt - contains results from gas sorption measurements). -
XANES Data (contains XANES data from powder samples of Cu₃(HHTP)₂, pristine Cu₃(HHTP)₂ electrodes, cycled Cu₃(HHTP)₂ electrodes from EDLCs, and standard samples). -
XRD Data (contains PXRD data).
Version
Software / Usage instructions
- CIF files used for simulations - can be opened with a text file editor.
- Conductivity measurement data - can be opened with a text file editor or Microsoft Excel.
- Electrochemistry measurement data - can be opened with a text file editor or with EC-Lab. EC-Lab (Biologic) is not freely available.
- Elemental analysis data - can be opened with a pdf reader, and a text file editor or Microsoft Excel.
- Gas sorption isotherms - can be opened with a text file editor or Microsoft Excel.
- XANES data - can be opened using the Athena program of the Demeter software package. This is free to download from https://bruceravel.github.io/demeter/.
- XRD data - can be opened with a text file editor or Microsoft Excel.
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Rights and licensing
Except where otherwised noted, this item's license is described as Attribution 4.0 International (CC BY 4.0)
Sponsorship
Faraday Institution (via University Of Sheffield) (FIRG017 160768)
Innovate UK (104384)
European Research Council (726380)
Isaac Newton Trust (13.21(c)/18.47(a))
Innovate UK (104384)
European Research Council (726380)
Isaac Newton Trust (13.21(c)/18.47(a))
• Oppenheimer Studentship, School of the Physical Sciences, University of Cambridge.
• Royal Society University Research Fellowship (UF100278), Royal Society.
• UK Materials and Molecular Modelling Hub for computational resources, which is partially funded by EPSRC (EP/P020194/1 and EP/T022213/1).
• Royal Society PhD funding, Royal Society.
• Winton Programme for the Physics of Sustainability, University of Cambridge.
• BP Next Generation Fellowship, Yusuf Hamied Department of Chemistry, University of Cambridge.
• UKRI Future Leaders Fellowship (MR/T043024/1), UK Research and Innovation.