Primary studyCore evidenceTransport Physics

Functionality in metal-organic framework minerals: Proton conductivity, stability and potential for polymorphism

Huskic I., Novendra N., Lim D.-W. et al. · Chemical Science · 2019 · 4923-4929

5materials
10samples
8synthesis routes
11measurements
48results
5claims and caveats

Evidence map

Open a family to keep every result attached to its sample, method and conditions.

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: High

Synthetic stepanovite and zhemchuzhnikovite analogues are proton-conductive MOF minerals, with ZH reaching almost 3 x 10-3 S cm-1 at 25 deg C and 90% RH.

Caveat: ST2 could not be measured above 70% RH because of deliquescence.

4927 · Results and discussion · Fig. 4 · Linked to 3 structured results

Phase AssignmentSupport assessment: High

ST1 and ST2 lose guest water upon mild heating to form crystalline dehydrated phases ST1d and ST2d while retaining the two-dimensional hcb framework layers.

4926 · Results and discussion · Fig. 2; Table 1 · Linked to 3 structured results

Structure Property LinkSupport assessment: High

Substituting aluminium for iron in ZH gives a more exothermic formation enthalpy from oxides than the ST polymorphs, indicating enhanced thermodynamic stability.

4926 · Results and discussion · Table 2 · Linked to 3 structured results

Structure Property LinkSupport assessment: Medium

Differences in conductivity between ST1, ST2 and ZH are tentatively linked to different hydrogen-bonded frameworks made by Mg(H2O)6(2+) ions and water guests.

Caveat: The authors describe this relationship as tentative.

4928 · Results and discussion · Fig. 4c-d; SI Fig. S1 · Linked to 3 structured results

Transport MechanismSupport assessment: High

Reduced conductivity after H/D exchange supports proton conduction rather than purely non-protonic ionic transport.

Caveat: The paper reports isotope-effect comparisons for ST1 and ZH, not ST2.

4928 · Results and discussion · SI Fig. S14-S15 · Linked to 4 structured results

Material identities

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

MaterialCompositionStructure contextSource
Stepanovite polymorph ST1NaMgFe(C2O4)3.9H2ONa+, Fe3+ and hexaaquamagnesium Mg(H2O)6(2+) charge-balancing cations · Oxalate (C2O4(2-))2D · PristineSynthetic stepanovite 1; ABCA'B'C' stacking of hcb sheets; R3c at 100 K.4925 · Results and discussion · Table 1; Fig. 1
Dehydrated stepanovite ST1dNaMgFe(C2O4)3.6H2ONa+, Fe3+ and Mg-aqua cations after guest-water loss · Oxalate (C2O4(2-))2D · PristineDehydrated ST1 with partial corrugation of hcb layers; R3.4926 · Results and discussion · Table 1; Fig. 3
Stepanovite polymorph ST2NaMgFe(C2O4)3.9H2ONa+, Fe3+ and hexaaquamagnesium Mg(H2O)6(2+) charge-balancing cations · Oxalate (C2O4(2-))2D · PristineSynthetic stepanovite 2; ZH-like AB stacking of hcb sheets; P3c at 298 and 100 K.4926 · Results and discussion · Table 1; Fig. 1
Dehydrated stepanovite ST2dNaMgFe(C2O4)3.6H2ONa+, Fe3+ and Mg-aqua cations after guest-water loss · Oxalate (C2O4(2-))2D · PristineDehydrated ST2 with corrugated hcb sheets preserving AB stacking; P3.4927 · Results and discussion · Fig. 3
Zhemchuzhnikovite analogue ZHNaMgFe0.4Al0.6(C2O4)3.9H2ONa+, mixed Fe3+/Al3+ nodes and hexaaquamagnesium Mg(H2O)6(2+) charge-balancing cations · Oxalate (C2O4(2-))2D · PristineZH-like hcb layers stacked along an approximately 12.6 A crystallographic c-axis with guest-filled channels.4923 · Introduction

Sample register

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

Show 10 sample records
SampleForm and roleProcessing and geometrySource
ST1 crystalsresearch_0541__mat__mat_st1Single Crystal · Target Sample · Pristine FrameworkSlowly evaporated large hexagonal plate-like crystals; hand-separated by morphology.4924 · Synthesis of ST1 and ST2
Deuterated ST1research_0541__mat__mat_st1Pellet · Target Sample · Guest LoadedParent phase dehydrated then recrystallized from D2O in dry N2.4925 · Deuterated ST1 and ZH
ST1 compacted pelletresearch_0541__mat__mat_st1Pellet · Target Sample · Pristine FrameworkCompacted powder pellet, 2.5 mm diameter, contacted with gold paste and 50 um gold wires.about 1.2 mm4925 · Alternative current (AC) impedance measurement
ST1d dehydrated single crystalresearch_0541__mat__mat_st1dSingle Crystal · Target Sample · Pristine FrameworkST1 single crystals gently heated at 50 deg C under vacuum for 12 h.4924 · Dehydration of ST1 and ST2 single crystals
ST2 crystalsresearch_0541__mat__mat_st2Single Crystal · Target Sample · Pristine FrameworkRapid evaporation/rotary evaporation product; elongated crystals with hexagonal cross-section.4924 · Synthesis of ST1 and ST2
ST2 compacted pelletresearch_0541__mat__mat_st2Pellet · Target Sample · Pristine FrameworkCompacted powder pellet, 2.5 mm diameter, contacted with gold paste and 50 um gold wires.about 1.2 mm4925 · Alternative current (AC) impedance measurement
ST2d dehydrated single crystalresearch_0541__mat__mat_st2dSingle Crystal · Target Sample · Pristine FrameworkST2 single crystals gently heated at 50 deg C under vacuum for 12 h.4924 · Dehydration of ST1 and ST2 single crystals
Bulk synthetic ZHresearch_0541__mat__mat_zhPowder · Target Sample · Mixed MetalBulk sample obtained by milling Fe and Al oxalate precursors with water.4924 · Synthesis of ZH
Deuterated ZHresearch_0541__mat__mat_zhPellet · Target Sample · Guest LoadedParent phase dehydrated then recrystallized from D2O in dry N2.4925 · Deuterated ST1 and ZH
ZH compacted pelletresearch_0541__mat__mat_zhPellet · Target Sample · Mixed MetalCompacted powder pellet, 2.5 mm diameter, contacted with gold paste and 50 um gold wires.about 1.2 mm4925 · Alternative current (AC) impedance measurement