3.6 Elektrochemische Energiematerialien
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The reuse of lithium-ion batteries (LIBs) from electric vehicles (EVs) in second-life applications such as battery energy storage systems (BESSs) offers significant environmental and economic benefits. Beyond economic considerations, safety management is a key challenge for large-scale deployment, yet the influence of ageing on LIB safety remains insufficiently understood. Preger et al., emphasized in their review the existing gap on data about electrical abuse and high-capacity cells. This laboratory-scale study investigates the evolution of key safety parameters over battery lifetime. The present study contribute to closing this gap studying three types of LIB cells (Nickel Manganese Cobalt (NMC) chemistry) from EV and hybrid EV batteries that were artificially aged and tested at three representative states of health (SOH): 100% (beginning-of-life, BOL), 80% (end of first life), and 60% (midpoint of second life). Cells were subjected to thermal abuse, overcharge, and accelerating rate calorimetry, with selected tests coupled to online gas analysis. Results show a pronounced ageing effect on thermal stability. The onset temperature of thermal runaway was reduced by 17–69 ◦C for aged cells (60% SOH) compared with BOL cells, while overcharge acceptance decreased by 13–78%. Although aged cells exhibited lower thermal stability, their thermal runaway reactions under inert conditions were less severe, as indicated by
lower maximum temperatures. These findings highlight the need to account for ageing-induced shifts in exothermic reaction onset and thermal runaway behavior when designing safe second-life BESS. Future work should extend the analysis to LFP chemistries especially as the market is expected to shift towards this chemistry and consider battery and system levels, including influence of ageing on thermal runaway propagation.
Understanding and tuning the local coordination environment of Fe−N4 macrocyclic catalysts are essential for advancing non-precious metal oxygen reduction reaction (ORR) electrocatalysis. Here, we present a comprehensive experimental and theoretical investigation of three structurally distinct Fe macrocycles, iron(tetraphenylporphyrin) chloride (FeTPP), iron(II) phthalocyanine (FePc), and iron aza-bridged bis-1,10-phenanthroline hexaaza-macrocycle (Fe(Phen2N2)), to unravel how bridging atom identity and coordination geometry impact ORR activity in alkaline media. These measurements identified FePc/CNT as the most active catalyst, followed closely by Fe(Phen2N2)/CNT, with FeTPP/CNT exhibiting the lowest performance. Density functional theory simulations further demonstrated that shorter Fe−N bonds and more electronegative bridging atoms correlate with weaker *OH adsorption and higher theoretical limiting potentials. Axial coordination can alter the adsorption energetics of ORR intermediates, thereby enhancing ORR activity. Together, these results highlight the critical influence on the ORR mechanism of macrocycle bridging atoms, coordination symmetry, and axial ligation, providing molecular-level insights to guide the rational design of Fe−N4 catalysts for alkaline fuel cell applications.
This study introduces a new porous carbon for electrochemical CO2 capture. Featuring both micro- and mesoporosity, it outperforms predominantly microporous YP80F (a commercial benchmark) by delivering faster CO2 adsorption and lower energy consumption. This highlights the importance of mesoporosity in designing improved supercapacitor electrodes for rapid, energy-efficient electrochemical CO2 capture.
The increasing demand for alkali-metal batteries, lithium and sodium, highlights the importance of recycling approaches. For batteries which encompass low-value components such as cobalt-free and sodium-ion, a requirement for low-cost and low-energy processes for recovery and reuse. In this respect, direct recycling, is preferred where the functional structure of active materials is preserved. In this study, a direct recycling route for sodium nickel-iron-manganese-copper oxide cathode material for sodium-ion batteries was investigated and preliminary results reveal the challenges in this direct recycling approach. Commercial sodium-ion battery cells were safely disassembled in a Glovebox and the positive electrode material was extracted via ice stripping. The recovered electrode material was structurally and compositionally characterised using scanning electron microscopy (SEM), X-ray diffraction (XRD), and inductive coupled plasma optical emission spectroscopy (ICP-OES) to assess morphology, crystallinity, and elemental stoichiometry.
Solid electrolytes (SE) allow to employ alkali-metal negative electrodes (NE) in new cell concepts, increasing energy density and safety of batteries for stationary and portable applications. The aim of this research is to develop a novel NASICON (NA Super Ionic CONductor) electrolyte for room-temperature (RT) sodium-sulfur (Na-S) cells employing a liquid sodium-potassium (Na-K) alloy at the SE/NE interface. The Na-K alloy can improve the interfacial contact between the sodium-metal NE and the SE.
Atomically dispersed Fe in N-doped carbon (Fe–N–C) catalysts are leading platinum-group-metal-free candidates for the O2 reduction reaction in proton exchange membrane fuel cells (PEMFCs). Zeolitic imidazolate framework (ZIF-8) derived Fe–N–C present the most promising performance; however, they possess a narrow distribution of small micropores, which limits active site accessibility. Here, to induce hierarchical porosity in Fe–N–C, we report a systematic study on MgCl2·6H2O-templated ZIF-8-derived Fe–N–C catalysts for the O2 reduction reaction. MgCl2·6H2O addition induced complete Zn removal, collapse of the ZIF-8 framework, and formation of large micro- and mesopores, with graphene-like structures. N content was markedly reduced, with conversion from pyridinic to pyrrolic N species. Rotating disc electrode tests showed a progressive increase in O2 reduction activity with MgCl2·6H2O, which is strongly correlated (R2 = 0.98) to the formation of large micropores and small mesopores (1–4 nm). This introduces an indirect structure–activity design principle for Fe–N–Cs. The enhanced Fe–N–C porosity also leads to increased degradation rates under accelerated stress test conditions, which we attributed to the oxidation of disordered carbon domains and active Fe loss. This study highlights a key trade-off between porosity-driven O2 reduction activity and durability in Fe–N–C catalysts.
Metal-organic frameworks (MOFs), particularly the zeolitic imidazolate framework (ZIF) family, are attractive precursors for advanced energy-storage materials. Upon pyrolysis, ZIFs can be transformed into electrically conductive carbon materials while preserving their original particle morphology, which is crucial for achieving high-performance sodium-ion battery anodes. Despite these advantages, large-scale implementation remains challenging due to the need for synthesis routes that balance performance, cost, and sustainability. The present study addresses these challenges by developing environmentally benign and economically feasible strategies for the scalable production of ZIF-8-derived carbon anodes suitable for industrial applications.
As the first commercial sodium-ion-batteries (SIBs) are available for purchase, it is possible to investigate material composition. Gaining an insight into the material composition of these SIBs is of interest not only for the classification of possible safety risks and hazards, but also in regard to recycling. Herein we report the preliminary investigations of the chemical and structural composition of first commercial SIB-cells.[1,2] Two different SIB-cell types were compared in terms of electrode size, thickness, loading etc. Furthermore, the composition of the active materials and electrolyte was investigated and compared. Finally, the gained results were linked to the different data sheet performance of the two cell types.
Chemically complex materials (CCMats) including high-entropy alloys, oxides, and related multi-principal element systems offer a paradigm shift in materials design by leveraging chemical diversity to simultaneously optimize functional, structural, and sustainability criteria. The vastness of the compositional and structural space in CCMats propels the field into an expanding exploratory state. To reconcile functional and structural performance across this immense parameter space remains an open challenge. This Perspective evaluates the opportunities and challenges associated with harnessing chemical complexity across a broad spectrum of applications, such as hydrogen storage, ionic conductors, catalysis, magnetics, dielectrics, semiconductors, optical materials, and multifunctional structural systems. It is delineated how three central design strategies: targeted substitution (SUB), defect engineering (DEF), and diversity management (DIV) enable the reconciliation of high functional performance with long-term structural stability and environmental responsibility.
Advances in computational thermodynamics, microstructure simulations, machine learning, and multimodal characterization are accelerating the exploration and optimization of CCMats, while robust data infrastructures and automated synthesis workflows are emerging as essential tools for navigating their complex compositional space. By fostering cross-disciplinary knowledge transfer and embracing data-driven design, CCMats are poised to deliver next-generation materials solutions that address urgent technological, energy, and
environmental demands.