Primary studyCore evidenceTransport Physics

Proton-electron coupling and mixed conductivity in a hydrogen-bonded coordination polymer

Park M., Ju H., Oh J. et al. · Nature Communications · 2025 · 1316

4materials
9samples
4synthesis routes
23measurements
63results
7claims and caveats

Evidence map

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Author interpretations and caveats

Paraphrased for this database from the authors’ stated interpretations — never quoted verbatim — and kept separate from reported measurements.

Application RelevanceSupport assessment: Medium

Ni-BAND gel memristors show humidity-dependent volatile analogue switching and synaptic potentiation/depression, attributed to proton-electron-coupled modification of Schottky barriers.

Caveat: Application results are from gel devices, not pristine thin-film transport devices; some conductance/current magnitudes are figure-axis estimates.

6 · Results · Fig. 6 · Linked to 5 structured results

Phase AssignmentSupport assessment: Medium

XPS and PXRD support formation of Ni-BAND films without detectable nickel nitrate or precursor impurity.

Caveat: XPS detection limits and amorphous impurity sensitivity are not quantified.

3 · Results · Supplementary Fig. 5 · Linked to 3 structured results

Structure Property LinkSupport assessment: Medium

The extensive H-bond network, hydrophilic NO3-/DMF/H2O components, and high-humidity multilayer water uptake support proton conduction in Ni-BAND.

Caveat: Authors also note weak H-bond fragments limit proton transport at low/intermediate humidity.

4 · Results · Fig. 3e; Fig. 4b · Linked to 5 structured results

Structure Property LinkSupport assessment: High

Ni-BAND thin films exhibit preferred orientation with bpy-Ni-bpy planes tending to lie on the substrate surface.

2 · Results · Fig. 3f-h · Linked to 1 structured result

Transport MechanismSupport assessment: High

Humidity switches the dominant charge-carrier regime from electron-dominant transport in Phases I/II to proton-dominant transport in Phase III.

Caveat: Interpretation is model-dependent on TLM analysis of EIS spectra.

4 · Results · Fig. 4e-h · Linked to 3 structured results

Transport MechanismSupport assessment: High

Ni-BAND is a high mixed protonic-electronic conductor at room temperature, combining 0.24 S/cm electronic conductivity under dry/low-RH conditions and 0.09 S/cm proton conductivity under high humidity.

Caveat: Proton conductivity is an EIS/TLM estimate rather than a direct separated DC measurement.

2 · Introduction · Fig. 1 · Linked to 2 structured results

Transport MechanismSupport assessment: Medium

High electrical conductivity is attributed to n-type doping stabilised by the conjugated bpy-Ni-bpy backbone and enhanced by nitrate-vacancy structural disorder.

Caveat: Nitrate vacancy effects are supported by DFT modelling; defect concentration in experimental films/gels is not directly quantified.

6 · Results · Fig. 5 · Linked to 5 structured results

Material identities

Names and aliases are kept exactly within the paper’s own identity model.

MaterialCompositionStructure contextSource
Ni-BAND{[Ni(bpy)(H2O)2(DMF)2](NO3)2.2DMF}nNi(II) centres, six-coordinate · 4,4'-bipyridine (bpy); coordinated DMF; coordinated H2O; nitrate and non-coordinated DMF in H-bond network1D · PristineHydrogen-bonded one-dimensional coordination polymer with parallel bpy-Ni-bpy chains forming a supramolecular H-bond network; triclinic P-1 by SCXRD.2 · Results · Fig. 3; Supplementary Tables 1-4
NO3- removed n-doped Ni-BAND computational modelNi-BAND model with non-coordinating nitrate removedNi(II) · bpy, DMF, H2O; nitrate-vacancy model1D · Model SystemDefect model representing n-doped Ni-BAND induced by nitrate vacancies.7 · Fig. 5 caption · Fig. 5f
Ni-BAND precursor[Ni(bpy)(H2O)2(NO3)2]nNi(II) · 4,4'-bipyridine1D · PristinePrecursor coordination polymer used to form Ni-BAND after dispersion in DMF.2 · Results · Fig. 2a
Pristine Ni-BAND computational model{[Ni(bpy)(H2O)2(DMF)2](NO3)2.2DMF}nNi(II) · bpy, DMF, H2O, nitrate1D · Model SystemPeriodic DFT model optimised from the SCXRD structure.2 · Supplementary Note 1 · Fig. 5e

Sample register

Sample form, processing state and composition status define the context for measurements.

Show 9 sample records
SampleForm and roleProcessing and geometrySource
Ni-BAND blue crystalsresearch_0561__mat__ni_bandSingle Crystal · Target Sample · Pristine FrameworkCrystals grown from filtered DMF dispersion, rinsed with MIBK and vacuum dried.8 · Methods · Fig. 2b,c
Ni-BAND gelresearch_0561__mat__ni_bandThin Film · Target Sample · Pristine FrameworkDip-coated or drop-dried from 0.375 g/mL filtered DMF dispersion.glass or PET · thick, separable gel; 2 cm x 2 cm example9 · Methods · Fig. 2e; Fig. 6a
Ni-BAND gel memristor deviceresearch_0561__mat__ni_bandElectrode · Target Sample · Pristine FrameworkGel introduced onto masked bottom-electrode device; Ag electrodes prepared with conductive paste.glass substrate with Au bottom electrodes and Ag conductive-paste electrodes9 · Methods · Fig. 6b
Nitrate-vacancy n-doped Ni-BAND DFT modelresearch_0561__mat__ni_band_n_doped_modelModel · Model System · ModelNO3- removed defect model used to examine n-doping.2 · Supplementary Note 1 · Fig. 5f
Ni-BAND powder/crystal-derived solidresearch_0561__mat__ni_bandPowder · Target Sample · Pristine FrameworkSolid Ni-BAND used for PXRD, BET and water-vapour adsorption.7 · Supplementary Figures · Supplementary Fig. 4; Supplementary Fig. 8
Pristine Ni-BAND DFT modelresearch_0561__mat__ni_band_pristine_modelModel · Model System · ModelPeriodic VASP model optimised from SCXRD structure.9 · Methods
Ni-BAND thin filmresearch_0561__mat__ni_bandThin Film · Target Sample · Pristine FrameworkSpin-coated from 0.1 g/mL DMF precursor dispersion after air-plasma substrate treatment.SiO2(300 nm)/Si, quartz, ITO glass, or PET · 300 nm2 · Results · Fig. 2d; Supplementary Fig. 1
Ni-BAND thin-film Au-electrode deviceresearch_0561__mat__ni_bandElectrode · Target Sample · Pristine FrameworkAu sputtered for 80 s through shadow mask on Ni-BAND thin film.SiO2/Si or quartz with sputtered Au electrodes · 300 nm film9 · Methods · Fig. 4a
Ni-BAND precursor precipitateresearch_0561__mat__ni_band_precursorPowder · Unknown · Pristine FrameworkFiltered and rinsed ethanol precipitate; stored dry.8 · Methods