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XZ
Verified CAS / Academic Author39 Decoded Studies

Prof. Xi Zhu

School of Science and Engineering, The Chinese University of Hong Kong, Shenzhen

Research Publications & English Decoded Briefs

Showing 39 publications
SCIENCE CHINA Materials2026DOI: 10.1007/s40843-026-4391-5

Simultaneous Modulation of Interfacial Dipole and Film Kinetics via Self-Assembled Monolayers for Low-Energy-Loss Organic Photovoltaics

Self-assembled monolayers (SAMs) enable precise tuning of the ITO/active layer interfacial dipole, yet their impact on the crystallization kinetics of the overlying active layer remains poorly understood, limiting their potential in high-efficiency organic solar cells. This study introduces THPC, a self-assembling material with an extended carbazole core and heteroatom substitution, as a hole transport layer (HTL). Unlike the hydrophilic PEDOT:PSS, THPC exhibits low surface energy, providing a favorable template that extends the film formation kinetics of the PM6:L8-BO-X blend by nearly 1.4 times, mitigating the explosive nucleation prevalent in PM6-based active layers. This promotes a highly ordered fibrous morphology and enhances vertical phase separation. The deep work function of THPC (5.32 eV) increases the built-in potential, reduces interfacial trap density, and facilitates charge extraction. Consequently, non-radiative recombination loss decreases from 0.243 eV to 0.227 eV, and the open-circuit voltage rises from 0.866 V to 0.883 V, yielding a power conversion efficiency (PCE) of 20.19%, outperforming the PEDOT:PSS control (18.67%). This finding is confirmed across multiple Y-series acceptors, all approaching 20% PCE. Notably, the D18:L8-BO system achieves a PCE of 20.55%, demonstrating broad applicability.

SCIENCE CHINA Materials2026DOI: 10.1007/s40843-026-4242-1

A Microenvironment-Adaptive Hydrogel Enabled by an MXene-Based Coordination Nanoreactor Drives Immune-Osteogenic Cascade for Infected Bone Defects Regeneration

Infected bone defects remain a formidable clinical challenge due to the coupled pathologies of bacterial infection and impaired osteogenesis. Conventional treatments often fail to address the dynamic microenvironment, leading to persistent infection and inadequate bone repair. Here, we report a microenvironment-adaptive hydrogel incorporating a Ti3C2Tx MXene-based coordination nanoreactor that orchestrates an immune-osteogenic cascade. The nanoreactor, constructed by coordinating Fe3+ ions onto MXene nanosheets, exhibits pH- and reactive oxygen species (ROS)-responsive release of Fe3+ and MXene, enabling sequential antibacterial and pro-osteogenic activities. In vitro studies demonstrated that the hydrogel eradicated Staphylococcus aureus and Escherichia coli (>99.9% killing) within 6 h via synergistic photothermal and chemodynamic effects, while simultaneously scavenging excess ROS to mitigate oxidative stress. Notably, the released Fe3+ ions promoted M2 macrophage polarization, as evidenced by a 2.5-fold increase in CD206 expression, and subsequently enhanced osteogenic differentiation of bone marrow mesenchymal stem cells (BMSCs), with alkaline phosphatase activity elevated by 1.8-fold and alizarin red staining intensity increased by 2.2-fold. In a rat model of infected calvarial defects, the hydrogel significantly accelerated bone regeneration, achieving a bone volume fraction of 78.4% at 8 weeks post-implantation, compared to 35.2% in the untreated control. Micro-CT and histological analyses confirmed robust new bone formation and complete infection clearance. This study presents a paradigm for designing adaptive biomaterials that integrate infection control and bone regeneration, offering a promising strategy for treating infected bone defects.

SCIENCE CHINA Materials2026DOI: 10.1007/s40843-026-4368-y

Liquid Metal Interconnects Overcome the Fill-factor Limitations of Stretchable Pixelated Electronic Devices

Stretchable pixelated electronic devices face a fundamental design conflict: accommodating mechanical deformation while preserving a high fill factor of active photosensitive elements. Conventional strain-relief strategies, such as pop-up, serpentine, and kirigami structures, rely on geometric unfolding that inevitably consumes inactive area, reducing pixel density and compromising photoresponse intensity, spatial resolution, and signal-to-noise ratio. In a recent breakthrough published in Nature Materials, Park et al. demonstrated a high-fill-factor silicon–liquid metal pixelated platform for multiscale visual acquisition and depth perception. The device integrates ~700-nm-thick ultrathin single-crystalline silicon photodiodes, finely patterned liquid metal interconnects, and a styrene–butadiene–styrene (SBS) elastomer substrate. The silicon pixels provide high-performance photoelectric conversion, while the liquid metal interconnects accommodate deformation, achieving a functional separation that mitigates the trade-off between pixel density and mechanical compliance. The device maintains stable photodiode characteristics and repeatable photoresponses under high-curvature hemispherical stretching and large biaxial tensile strain. Two applications were demonstrated: a human-eye-inspired robotic vision system with a curved photosensitive surface for wide-field imaging, and an epidermal, lensless, near-contact imaging device for close-range image acquisition. These systems enable multiscale visual acquisition and depth perception, offering a scalable route for future stretchable visual electronics.

SCIENCE CHINA Materials2026DOI: 10.1007/s40843-026-4287-1

Metal Atomic Clusters for Oxygen-Bearing Materials: From Adversity Comes Opportunity

Atomic-level manufacturing is a frontier technology enabling materials to achieve ultimate performance. This study explores the potential applications and critical scientific issues of metal atomic clusters, which are predominantly used in catalysis but suffer from intrinsic instability, leading to low yield, inconsistent size and structure, and susceptibility to agglomeration, oxidation, and sintering. We propose a novel concept: employing oxidized metal atomic clusters as dopants in oxygen-bearing materials, such as oxide dispersion strengthened (ODS) alloys, oxide-based cermets, and toughening ceramics. Using ODS alloy as a proof-of-concept, Ni-NiO coupled cluster-strengthened metallic Ni exhibits finer grains, a larger proportion of low-angle grain boundaries, higher geometrically necessary dislocation density, and achieves a 38% enhancement in Vickers hardness. To advance this concept, four critical scientific issues require resolution: oxidation control, disaggregation and dispersion, effectiveness comparison, and physicochemical behaviors and mechanisms. This work bridges the gap between atomic-level manufacturing and structural materials, offering a pathway to overcome the instability of metal clusters by leveraging their oxidation characteristics.

SCIENCE CHINA Materials2026DOI: 10.1007/s40843-026-4110-9

An Ionic Hydrogel-Based 3D Force Sensor for Multidimensional Password Input and Enhanced Security

Flexible tactile sensors are pivotal for human-machine interaction, yet accurate decoupled sensing of three-dimensional (3D) forces and integration into functional systems remain challenging. Here, we present a piezoresistive 3D force sensor based on ionic hydrogels that detects and analyzes multi-directional forces. The sensor exhibits a linear response to normal forces from 1 to 25 N (R²=0.99) and maintains stable sensitivity for shear forces within 0–4 N. By incorporating both force magnitude and direction, the sensor enables multidimensional password input, expanding traditional one-dimensional passwords into numeric, alphabetic, and Morse code formats. Experimental results demonstrate significant potential for enhancing information security. The sensor's simple structure, mature fabrication, and ease of integration with flexible electronics underscore its practicality. This work addresses the bottleneck of unidirectional sensing in conventional flexible pressure sensors, offering a robust solution for multidimensional force acquisition in human-machine interfaces, soft robotics, and biomechanical monitoring.

SCIENCE CHINA Materials2026DOI: 10.1007/s40843-025-3664-x

Enhancing interfacial bonding and compositional synergy in ANF-PPy/Ag-MXene/ANF-PPy multilayer heterostructures for efficient electromagnetic interference shielding and infrared thermal camouflage

The proliferation of electronic devices and wireless communications has escalated the demand for materials that simultaneously provide electromagnetic interference (EMI) shielding and infrared (IR) thermal camouflage, a combination critical for military and civilian applications. Traditional metallic shields suffer from high density, poor processability, and cost, while polymer-based alternatives often lack sufficient shielding effectiveness and environmental stability. Here, we report a multilayer composite film fabricated via layer-by-layer vacuum filtration and hot-pressing, integrating modified aramid nanofibers (ANF) and MXene (Ti3C2Tx) nanosheets. The film architecture comprises ANF-polypyrrole (ANF-PPy) as the matrix and Ag-MXene as the functional filler, with in-situ grown Ag nanoparticles intercalating between MXene layers to enhance interlayer spacing and electromagnetic wave scattering. At a thickness of only 33 μm, the film achieves an average EMI shielding effectiveness (SE) of 66.75 dB and a specific shielding effectiveness (SSE/t) of 38432.54 dB cm2 g−1. The multilayer structure promotes multiple internal reflections and interfacial polarization losses, while the tight integration ensures high IR reflectivity. This work establishes a foundation for developing multifunctional protective materials with dual EMI shielding and IR camouflage capabilities, addressing the critical bottleneck of simultaneous performance in ultrathin, flexible formats.

SCIENCE CHINA Materials2026DOI: 10.1007/s40843-025-3685-7

Suppressing the aggregation and optimizing the electronic structure of porous Ni nanosheets by POMs-derived Mo2N for efficient hydrogen evolution in AEM water electrolysis

NiMo-based catalysts are promising for the hydrogen evolution reaction (HER), yet optimizing their electronic structure and enhancing mass transfer remain challenging. Here, we report a route to synthesize two-dimensional (2D) porous Mo2N-Ni heterojunction nanosheets with tuned Ni/Mo ratio for enhanced alkaline HER. The precursor is assembled from polyoxometalate clusters (PMo12) and layered Ni(OH)2. The interaction between PMo12 and Ni(OH)2 suppresses particle agglomeration during pyrolysis, yielding 2D porous sheets composed of small Mo2N-Ni units. Electron transfer from Ni to Mo2N redistributes electrons at the heterojunction, optimizing intermediate adsorption/desorption. The porous structure enhances mass transfer, reducing catalyst impedance. The optimized catalyst exhibits an overpotential of 19 mV at 10 mA cm−2, comparable to commercial Pt/C. An anion exchange membrane (AEM) electrolyzer pairing this catalyst with NiFe-LDH achieves 500 mA cm−2 at 1.80 V and operates stably for 300 h. This assembly method offers a scalable strategy for efficient catalyst production.

Environmental Chemistry2026DOI: 10.7524/j.issn.0254-6108.2024112101

Combined Effects of Biochar and Riboflavin on the Reduction of Hexavalent Chromium by Shewanella oneidensis MR-1

The biological reduction of Cr(VI) to less hazardous Cr(III) is a promising strategy for remediating Cr(VI)-contaminated sites. Both biochar and riboflavin can act as electron shuttles to accelerate this bioreduction process, yet their combined effects remain poorly understood. Using Shewanella oneidensis MR-1 as a model reducing bacterium, we investigated the joint influence of biochar (average particle size 28.85 μm) and riboflavin at high (1 mmol·L−1) and low concentrations on Cr(VI) bioreduction. Individually, biochar and high-concentration riboflavin enhanced indirect electron transfer, accelerating Cr(VI) removal. However, when combined, the fast-phase reaction rate (rf0) did not significantly improve compared to single amendments. The combined action factor revealed an antagonistic inhibition between biochar and riboflavin. Mechanistically, high-concentration riboflavin saturated biochar's adsorption sites (equilibrium concentration 0.96±0.04 mmol·L−1), hindering biochar's role as an electron conduit. With a bacterial density of 3.4×10^7 cells·mL−1, the inter-bacterial distance (30.87 μm) exceeded biochar's particle size, and the per-cell riboflavin concentration (2.9×10−2 pmol·cell−1) was sufficient for riboflavin to dominate as the primary electron shuttle, while biochar's surface became coated, reducing its efficacy. These findings reveal the complex interplay between biochar and soluble organic matter in Cr(VI) bioreduction, underscoring the need to consider such antagonistic effects when designing bioremediation strategies for multi-component contaminated environments.

Journal of Environmental Engineering Technology2026DOI: 10.13205/j.hjgc.202604017

Multi-Scenario Simulation of Water Yield Services in the Shule River Basin Based on Climate and Land Use Changes

The Shule River Basin, a typical arid inland river basin, faces critical water scarcity that threatens ecological security and sustainable development. This study integrated the FLUS and InVEST models to simulate water yield in 2030 and 2050 under three climate scenarios (SSP119, SSP245, SSP585). Geographic detectors quantified the driving mechanisms of natural and human factors. Results showed: (1) Desert dominates land use (78.6% in 2020). Under SSP119, desert area decreases by 0.69% by 2050, while under SSP585 it expands by 5.7%, with grassland loss of 23.0%, indicating severe ecological degradation. (2) Water yield exhibits a south-high, north-low spatial pattern, with high values in glacier-covered and high-altitude areas. SSP119 yields the most significant increase (147.6×10^8 t by 2050), whereas SSP585 shows minimal increase (43.9×10^8 t) due to extreme climate. (3) Precipitation and DEM are core driving factors; the interaction between land use type and precipitation has the strongest influence, implying that artificial land use changes can significantly regulate water yield. This multi-scenario framework provides decision support for water resource management and ecological governance in arid inland river basins.

The Chinese Journal of Process Engineering2026DOI: 10.12034/j.issn.1009-606X.225159

Improvement of Homogeneity for Direct Cooling Battery Thermal Management System in Electric Vehicles under Dynamic Operating Conditions

Lithium-ion batteries are widely used in electric vehicles due to their high energy density, long cycle life, and stability. However, significant heat generation caused by power fluctuations under dynamic driving conditions poses substantial challenges to battery safety and longevity. Existing research often focuses on thermal behavior under fixed ambient temperatures or constant discharge rates, failing to replicate real-world dynamic operations. This study investigates the thermal performance of a 52 Ah battery pack under three typical dynamic operating conditions: steady operation, alternating load operation, and progressive acceleration. Experiments were conducted at ambient temperatures of 25, 30, and 35°C. Results show that the direct cooling thermal management system meets temperature control requirements during steady and alternating load operations at all tested temperatures. However, under progressive acceleration at 35°C, the battery pack's maximum surface temperature reaches 49.8°C with a significant temperature difference of 16.5°C, exceeding safe limits. After installing aluminum fins, the maximum temperature is reduced to 40.9°C, and the temperature difference drops to 5.0°C. Longitudinal temperature difference decreases from 11.2°C to 4.6°C, and transverse temperature difference from 5.9°C to 1.2°C. The fins enhance longitudinal heat conduction and mitigate transverse temperature imbalance. These findings underscore the importance of optimizing thermal management strategies and provide experimental data for developing more effective systems, contributing to improved battery safety and longevity under real-world driving conditions.

SCIENCE CHINA Materials2026DOI: 10.1007/s40843-026-4094-8

Steric Encapsulation of Multi-Resonance TADF Emitters Enabling Narrowband Deep-Blue OLEDs with High Efficiency and High Brightness at Elevated Doping Levels

Deep-blue multi-resonance thermally activated delayed fluorescence (MR-TADF) emitters with high efficiency, high color purity, and high brightness are critically important for next-generation OLED displays, yet remain challenging due to severe aggregation and host-guest interactions in the solid state. Herein, we report a core-encapsulating molecular design strategy in which bulky and non-conjugated peripheral groups are introduced to sterically encapsulate a blue-emitting MR core, thereby suppressing intermolecular π-π interactions without perturbing its intrinsic electronic structure. Two new emitters, DNa-BN and QNa-BN, featuring half-encapsulated and fully encapsulated MR-core architectures, respectively, were developed. Owing to its fully encapsulated structure, QNa-BN exhibits pronounced aggregation resistance at high doping concentrations, maintaining photoluminescence quantum yields exceeding 96%, radiative decay rate constants on the order of 10^8 s−1, and fast reverse intersystem crossing rates (~10^5 s−1). Consequently, sensitizer-free OLEDs based on QNa-BN deliver narrowband deep-blue emission at 458 nm with a full width at half maximum of 22 nm, CIE coordinates of (0.142, 0.085), a maximum external quantum efficiency (EQE_max) of 34.4%, and a maximum luminance exceeding 20,000 cd m−2. Furthermore, by adopting a hyperfluorescence architecture, the EQE_max is further boosted to 38.7% with significantly suppressed efficiency roll-off. This work demonstrates that steric encapsulation of the MR core provides an effective and general approach to achieving aggregation-resistant, high-efficiency, and high-brightness deep-blue MR-TADF emitters for OLED applications.

SCIENCE CHINA Materials2026DOI: 10.1007/s40843-025-3470-6

Aqueous-Isopropanol-Based Green Ink Formulation of Single-Crystalline Transition Metal Chalcogenides for Fully-Printed Strain-Insensitive Flexible Sensing Electronics

Inkjet printing of two-dimensional transition metal chalcogenides (TMDs) is promising for low-cost, large-scale flexible electronics, yet challenges persist due to poor crystallinity and toxic solvents. Here, we report a green ink formulation using zwitterionic cocamidopropyl betaine (CAB) as a dispersant and surfactant for liquid-phase exfoliation of single-crystalline TMDs in water and isopropanol (IPA). The dispersions contain no additives or binders, enabling direct production of stable (over one month) and concentrated (2 mg/mL) inks for MoS2, MoTe2, WS2, WSe2, and WTe2. Fully-printed MoSe2/CAB humidity sensors exhibit superior sensitivity (ΔI/I0 = 468.1) and rapid response/recovery times (27 s/0.42 s) under bending. Inkjet-printed WTe2/CAB pads on 6-μm-thick substrates demonstrate exceptional mechanical stability, with resistance variations of 1.4% under single bending and 2% after 1,000 cycles, and acquire high-quality electrocardiogram (ECG) and electromyography (EMG) signals. This strategy enables scalable fabrication of TMD-based flexible electronics, advancing industrial integration.

SCIENCE CHINA Materials2026DOI: 10.1007/s40843-026-4054-x

Strengthening d-p Orbital Hybridization by Fluorine Modification for Efficient Oxygen Evolution Reaction

The sluggish kinetics and high onset potentials of the oxygen evolution reaction (OER) at the anode of alkaline water/seawater electrolyzers limit overall energy efficiency. Noble-metal oxides like RuO2 are active but suffer from high cost, agglomeration, and dissolution under oxidizing potentials, especially in chloride-rich electrolytes where competing chloride oxidation reaction (ClOR) occurs. Here, we report a mild two-step dry-wet milling strategy to achieve throughout lattice doping of F− into MnO2 (F-MnO2) and subsequent anchoring of atomically dispersed Ru via Ru–O/F hybrid bonds. The strengthened Mn 3d–O/F 2p hybridization and negative charge shielding of surface F− enhance OER activity/selectivity relative to ClOR and impart superior Cl− tolerance and corrosion resistance. The resulting F-Ru-MnO2-TH electrocatalyst exhibits overpotentials of 280 mV and 200 mV at 10 mA cm−2 in alkaline water and simulated seawater, respectively. It retains ~100% of initial activity after 200 h continuous operation in alkaline media and >95% after 300 h in simulated seawater, significantly outperforming Ru-MnO2 and commercial RuO2. This work provides a scalable route to durable, high-performance OER catalysts for seawater electrolysis.

New Carbon Materials2026DOI: 10.1016/S1872-5805(26)61094-3

Progress in Iodine Host Materials for Aqueous Zinc-Iodine Batteries: From Physical Confinement, Chemical Adsorption to Electrocatalysis

Aqueous zinc-iodine (Zn-I2) batteries are promising for large-scale energy storage due to their intrinsic safety, low cost, and high theoretical capacity (211 mAh g−1 for iodine). However, their practical application is hindered by the poor electronic conductivity of iodine, sluggish redox kinetics, and the shuttle effect of polyiodides. This review systematically analyzes the reaction mechanisms of iodine cathodes, including two-electron (I−/I2) and multi-electron (I−/I2/I+ and I−/I2/I+/IO3−) pathways, and identifies key bottlenecks. It then comprehensively summarizes recent advances in iodine host materials, categorized into three strategies: physical confinement, chemical adsorption, and electrocatalysis. Representative host materials such as porous carbons, covalent organic frameworks (COFs), porous aromatic frameworks (PAFs), polymers, MXenes, and Prussian blue analogs (PBAs) are discussed, with emphasis on the structure–performance relationships. The review highlights that heteroatom doping (e.g., nitrogen) enhances chemical adsorption of iodine species, while single-atom catalysts (e.g., Co, Zn) provide electrocatalytic sites that accelerate conversion kinetics. Finally, future research directions are proposed, including exploration of multi-electron systems, mechanistic elucidation of iodine conversion, development of advanced host materials, and optimization of zinc anodes, to accelerate the commercialization of Zn-I2 batteries.

Environmental Chemistry2026DOI: 10.7524/j.issn.0254-6108.2025011303

Pollution Characteristics of Polybrominated Diphenyl Ethers in Coastal Seawater of Dalian

Polybrominated diphenyl ethers (PBDEs) are persistent organic pollutants with environmental persistence, bioaccumulation, and toxicity, posing significant threats to marine ecosystems and human health. This study developed an analytical method using anhydrous sodium sulfate-alumina composite column chromatography coupled with gas chromatography-orbitrap mass spectrometry to quantify mono- to deca-BDEs in coastal seawater of Dalian, China. The total PBDE concentrations (∑PBDEs) ranged from not detected to 511.96 pg·L−1, with a mean of 163.96 pg·L−1. BDE-209 was the dominant congener, contributing 24.1% to ∑PBDEs. Spatial distribution exhibited distinct heterogeneity, with higher abundances of highly brominated PBDEs near sewage discharge outlets. Partial least squares discriminant analysis indicated that anthropogenic activities, particularly sewage discharge, were the primary sources. Ecological risk assessment revealed extremely low risk, with the highest risk quotient of 0.013 for BDE-17. These findings provide baseline data for PBDE contamination in Dalian coastal waters and underscore the need for continued monitoring of emerging contaminants.

SCIENCE CHINA Materials2026DOI: 10.1007/s40843-025-3802-0

Constructing built-in electric field in crystalline-amorphous heterostructure bifunctional electrocatalysts for highly efficient overall water splitting at high current density

Exploring efficient bifunctional electrocatalysts for both hydrogen and oxygen evolution reactions is key to water electrolysis. However, the inherently slow reaction kinetics of electrocatalysis are constrained by mass transfer limitations and unsuitable adsorption/desorption dynamics. Herein, a Fe-doped-Ni3S2/NiFeCoCeIn oxide hydroxide (FNS/HEOXY) crystalline–amorphous heterostructure electrocatalyst with a large work function difference (ΔΦ) and strong built-in electric field (BEF) is successfully designed and synthesized. Benefiting from the electron transfer behavior from FNS to HEOXY, the FNS/HEOXY shows outstanding catalytic activity for both hydrogen and oxygen evolution, along with ultra-high stability in an alkaline medium at an industrial-level current density. Moreover, the anion exchange membrane water electrolyzer (AEMWE) assembled by the FNS/HEOXY requires only a minimal cell voltage of 1.83 V to reach 1 A cm−2 at 80 °C. Both experimental and theoretical results confirm the interfacial charge redistribution induced by the strong BEF, thus finely optimizing the adsorption energy. This work proposes a new design principle toward efficient electrocatalysts for energy conversion.

SCIENCE CHINA Materials2026DOI: 10.1007/s40843-025-3993-y

Nucleation and growth mechanisms of TiB2 particles in copper matrix composites prepared by melt dispersion-turbulent mixing in-situ reaction method

Conventional liquid-phase in-situ synthesis of Cu-TiB2 composites often suffers from coarse and non-uniformly distributed reinforcements, stemming from insufficient understanding and control over the in-situ nucleation and growth mechanisms of TiB2 particles. This study introduces a novel melt dispersion-turbulent mixing (MDTM) in-situ reaction technology to fabricate high-performance Cu-TiB2 composites. The MDTM strategy synergistically refines reaction micro-regions by reducing the initial melt droplet size via melt dispersion while enhancing solute convection via turbulence, promoting high-density nucleation and refinement of TiB2 particles. Based on turbulence characteristics and in-situ reaction kinetics, we optimized the melt disperser parameters and established a quantitative model linking particle size to disperser rotation speed and reactant solute concentration. It was found that disperser rotation speed governs three distinct nucleation and growth mechanisms for TiB2 particles. Low-density nucleation at low disperser rotation speeds (0–50 r/min) leads to coarse TiB2 particles. At medium rotation speeds (100–150 r/min), the refinement of micro-regions in the dual-melt reaction achieves high-density TiB2 nucleation. Conversely, at high rotation speeds (150–200 r/min), intense turbulence weakens the nucleation driving force and induces TiB2 particle coarsening. This work provides new insights into liquid-phase in-situ reaction mechanisms and offers a novel, controllable route for fabricating high-performance micro/nano particle-reinforced metal matrix composites.

Journal of Fuel Chemistry and Technology2026DOI: 10.1016/S1872-5813(26)60701-3

Construction of electron-rich active sites in the metallic active phase of iron-based hydrogenation catalysts and their regulation on HDN pathway selectivity

Hydrodenitrogenation (HDN) is an effective method for removing nitrogen-containing heteroatom compounds from inferior feedstocks, with the core challenge being the development of catalysts that combine low cost and high performance. In this study, a FeZn-supported catalyst was modified by introducing six different metal promoters (La, Ti, Ce, Mn, Mg, and Cr). It was found that Cr exhibited a pronounced promotional effect on HDN performance. The promoting effect of Cr on the FeZn catalyst's activity originates from its electronic interaction with sulfided Fe species, rather than functioning as an independent active site. Specifically, Cr and Zn species act synergistically as electron donors, transferring electron density to the sulfided Fe species, thereby modulating the electronic structure of Fe to render it in an electron-rich state. This increased electronic density weakens the Fe–S bonds in the active phase, promoting their cleavage and facilitating the formation of hydrogenation active sites known as coordinated unsaturated sulfur vacancies (CUS). After introducing 3% Cr, under conditions of 340–380 °C, 4 MPa pressure, and a high weight hourly space velocity (WHSV) of 8.7 h−1, the catalyst's HDN conversion rate for the basic nitrogen compound quinoline increased by 14.5%–19.7% compared to the unmodified catalyst, reaching 81.9% at 380 °C. Furthermore, Cr introduction increased the number of medium-strength Lewis acid sites, which work synergistically with the increased CUS sites to enhance overall hydrogenation activity. Cr addition effectively governs the selectivity of the HDN pathway, with the reaction rate constant for the deep hydrogenation pathway over the FeZn3Cr@GA catalyst reaching 3.2 times that of the unmodified FeZn@GA catalyst. In summary, using Fe as the primary active metal component and regulating its electronic structure through promoters represents an effective approach for designing low-cost, high-performance HDN catalysts.

Environmental Chemistry2026DOI: 10.7524/j.issn.0254-6108.2025092801

Seasonal Variations of Dissolved Organic Matter (DOM) in Urban Riverine Outfall Water and Its Association with Water Quality: A Case Study of the Nanfei River and Banqiao River in Hefei

Urban river water quality is critically influenced by outfall discharges, yet the seasonal dynamics of dissolved organic matter (DOM) and its linkage to water quality remain poorly constrained. This study collected outfall water samples seasonally during 2023–2024 along the Nanfei River and Banqiao River in Hefei, Anhui Province. Parallel factor analysis of excitation-emission matrices identified three fluorescent components: fulvic acid-like C1, tryptophan-like (protein-like) C2, and terrestrial humic-like C3. Seasonal variations were pronounced: protein-like C2 dominated in winter and spring, whereas summer and autumn showed lower C2 proportions due to rainwater dilution and urban nonpoint source runoff inputs. Water quality indices decreased in summer and autumn, primarily attributed to dilution by rainfall runoff. Fluorescence index (FI > 1.9) and biological index (BIX > 1.0) indicated predominantly autochthonous DOM sources. During summer and autumn, humification index (HIX) and specific UV absorbance (SUVA) increased, while spectral slope ratio (SR) decreased, suggesting enhanced terrestrial and urban runoff influence. Significant positive correlations were observed between protein-like C2 and terrestrial humic-like C3 with water quality parameters, indicating their utility as precise indicators of pollution sources and seasonal water quality variations. These findings provide a scientific basis for integrated management of urban outfalls.

Environmental Chemistry2026DOI: 10.7524/j.issn.0254-6108.2025022801

Combined Effects of Biochar and Dissolved Organic Matter Surrogate AQDS on Methane Emissions from Paddy Soil

Paddy soils are a major source of agricultural methane (CH4) emissions. Biochar is widely applied to paddy soils, while dissolved organic matter (DOM) is ubiquitous; both can regulate CH4 emissions by mediating electron transfer processes, yet their synergistic mechanisms remain unclear. This study investigated the individual and combined effects of biochar and the DOM model compound anthraquinone-2,6-disulfonic acid (AQDS) on CH4 emissions from paddy soil during incubation. Biochar amendment increased DOM concentration and accelerated extracellular electron transfer, resulting in a maximum cumulative CH4 emission of (66.23±16.20) μmol, four-fold higher than the control (15.14±0.18) μmol. In contrast, AQDS addition markedly suppressed CH4 accumulation to (1.04±0.09) μmol, attributed to sulfate introduction as a competitive electron acceptor, despite enhanced electron exchange. The combined biochar-AQDS treatment yielded intermediate CH4 accumulation of (12.71±0.32) μmol. Although DOM availability increased, sulfate-driven electron competition inhibited methanogens, and the combined treatment favored the acetoclastic methanogenesis pathway, which produces less CH4 per unit acetate, resulting in lower emissions than biochar alone but higher than AQDS alone, indicating an additive effect. These findings elucidate the mechanisms by which biochar and DOM jointly regulate CH4 emissions from paddy soils, providing a theoretical basis for agricultural management.

Chinese Journal of Environmental Engineering2026DOI: 10.12030/j.cjee.202511078

Multi-step Wet Enhanced Removal of Chlorine and Heavy Metals from Municipal Solid Waste Incineration Fly Ash

Municipal solid waste incineration (MSWI) fly ash contains high levels of soluble chlorine and heavy metals, posing environmental risks. This study employed a sequential wet treatment process (water washing–water washing–acid washing–water washing) at a low liquid-to-solid ratio of 2:1 L·kg⁻¹ to enhance the removal of chlorine and heavy metals. Acetic acid and a mixed acid (acetic acid:sulfuric acid molar ratio 1:1) were used as acid washing agents. Results showed that the soluble chlorine content decreased from 23.96% in the raw ash to approximately 0.6%, achieving a removal efficiency of 97.5%. The 3 mol·L⁻¹ acetic acid group exhibited high removal efficiencies for Pb, Cu, and Cd at 52.97%, 29.60%, and 61.54%, respectively, while increasing the stable fraction of heavy metals. However, excessive dissolution of Ca and Al occurred. The mixed acid group demonstrated a 6.9-fold higher 'calcium retention' capacity compared to acetic acid alone, attributed to the presence of sulfate. After treatment, the leaching concentrations of Pb and Zn were significantly reduced to 0.001 mg·L⁻¹ and 0.05 mg·L⁻¹, respectively, meeting the limits of the 'Technical Specification for Pollution Control of MSWI Fly Ash' (HJ 1134—2020). The treated ash exhibited a CaO-SiO₂-MgO-Al₂O₃ system, suitable for building material applications. This study provides technical support for on-site, building-material-oriented disposal of MSWI fly ash.

SCIENCE CHINA Materials2026DOI: 10.1007/s40843-025-3918-x

Oxygen Anion-Mediated Electron Pump Suppressed Iron Segregation in Cobalt-Iron Catalyst Boosts Ampere-Scale Seawater Electrolysis

Electrochemical seawater electrolysis powered by renewable energy is a highly promising route toward sustainable hydrogen production, mitigating both energy shortages and carbon emissions. However, chloride-induced corrosion and competitive chlorine evolution reactions lead to metal site dissolution, severely impairing durability, especially at industrial-level current densities. Here, we report a nitrite-incorporated cobalt-iron layered double hydroxide (CoFe-NO2−-LDH) electrocatalyst that exhibits exceptional activity and stability for seawater splitting. The nitrite anion acts as an electronic pump: it accepts electrons to facilitate the formation of high-valence Fe species essential for initial OER activation, and donates electrons under high potential to suppress oxidative dissolution. Moreover, the negatively charged nitrite generates an electrostatic repulsion field that effectively repels chloride ions, protecting metal active sites from corrosion and segregation. The in situ characterization confirms that nitrite doping weakens the Fe–O covalency, which suppresses lattice oxygen participation and promotes a stable adsorbate-evolving mechanism, consequently leading to significantly enhanced operational stability. When used as an anode, the CoFe-NO2−-LDH catalyst achieves over 1000 h of stable operation at 1000 mA cm−2 in seawater electrolysis, demonstrating great potential for practical applications.

SCIENCE CHINA Materials2026DOI: 10.1007/s40843-025-3825-x

Correlating the dielectric properties with chain packing density of polar functionalities in hyperbranched polyimides

Polymer-based dielectric materials with high energy density and thermal stability are critical for modern electric/electronic industries. Polyimide (PI) based materials are promising due to their high temperature resistance and chemical inertness, yet their inherently low dielectric constant and limited charge-discharge energy density restrict applications in film capacitors. While incorporating ferroelectric or conductive fillers can enhance dielectric performance, batch-to-batch inconsistency and physical deterioration remain problematic. This study focuses on molecular structure design and modulation, preparing hyperbranched polyimides with different dianhydride monomers and branching degrees. The effects of chain packing density with polar groups on dielectric and energy storage performances were systematically investigated via experimentation and molecular simulation. Results demonstrate a significant correlation between monomers' electrical distribution and packing density in polymer systems. Molecular simulation further elucidated the underlying mechanism. This work establishes a foundation for designing polymer-based dielectric materials with high dielectric and energy storage performances at the molecular level.

Journal of Environmental Engineering Technology2026DOI: 10.13205/j.hjgc.202608018

Research progress on Ru-based catalysts for catalytic oxidation of chlorinated volatile organic compounds

Chlorinated volatile organic compounds (CVOCs) are volatile, difficult to degrade, and highly toxic, posing serious threats to the atmospheric environment and human health. Catalytic oxidation is currently one of the mainstream methods for CVOCs abatement, owing to its high efficiency, safety, and economic feasibility, and its key aspect lies in the design and development of high-performance catalysts. In the catalytic oxidation of CVOCs, the poisoning effect of chlorine species on catalysts severely restricts catalytic performance. Ru-based catalysts, which exhibit excellent catalytic oxidation activity toward CVOCs and favorable chlorine-resistant performance, have been widely studied in recent years. This paper reviews the latest research progress on Ru-based catalysts for the catalytic oxidation of CVOCs. The mechanism of catalytic oxidation of CVOCs by Ru-based catalysts is elucidated through a systematic analysis of the relevant literature. Furthermore, the strategies for the design and structural regulation of Ru-based catalysts are outlined from the perspectives of active components, supports, and surface modification. Finally, novel preparation methods for Ru-based catalysts and the influence of reaction components on catalytic performance are summarized. Future research directions in this field are also prospected, aiming to provide a reference for the subsequent design and development of high-performance Ru-based catalysts suitable for complex operating conditions.

Journal of Environmental Engineering Technology2026DOI: 10.13205/j.hjgc.202608026

Nitrogen Mineralization Effects of Bacillus subtilis Combined with Straw Biochar in Dryland Soil

Biochar and microbial inoculants are widely used for agricultural soil amendment. To investigate the effects of different straw biochars and Bacillus subtilis inoculant, applied individually or combined, on nitrogen transformation in dryland soil, a 60-day laboratory incubation experiment was conducted with six treatments: control (CK), 4% rice straw biochar (S), 4% rapeseed straw biochar (Y), 4% rice straw biochar plus 5 mg/kg inoculant (SJ), 4% rapeseed straw biochar plus 5 mg/kg inoculant (YJ), and inoculant alone (J). Results showed that rice straw biochar significantly increased soil nitrate nitrogen content by 148.74%–152.68% compared to CK, enhancing nitrification. Combined application with inoculant further increased average net nitrogen mineralization rate by 77.28%–99.38%. Conversely, rapeseed straw biochar decreased nitrate nitrogen by 51.66%–57.61%, and combined application reduced net nitrogen mineralization rate by 82.07%–84.73%. Treatments S, Y, SJ, and YJ promoted microbial biomass nitrogen (MBN) synthesis, with S and Y increasing MBN by 2.02- and 2.20-fold over CK, respectively. Combined treatments further increased MBN by 103.26%–149.44% relative to single biochar treatments. These findings indicate that biochar type governs nitrification and net nitrogen mineralization, while combined application exerts synergistic effects on MBN. For comprehensive dryland soil improvement, YJ treatment is optimal, reducing inorganic nitrogen loss risk and enhancing microbial nitrogen activity.

SCIENCE CHINA Materials2026DOI: 10.1007/s40843-025-4034-3

Active Site Concentration Steers the Reaction Pathway of CO2 Electroreduction

The local concentration and configuration of active sites critically influence the selectivity of CO2 electroreduction, yet constructing well-defined structures to probe this relationship remains challenging. Here, we report a molten salt-assisted strategy to synthesize Ce-Ov-Cu cascade catalysts with tunable configurations and relative concentrations of Cu and Ce-Ov sites. Two distinct geometries were engineered: one with dense Cu sites surrounding Ce-Ov (Cu10CeOx) and another with isolated Cu centers encapsulated by Ce-Ov (CuCe10Ox). These configurations direct key intermediates (*CHO or *COH) toward either C-C coupling or deep hydrogenation, thereby switching product selectivity. CuCe10Ox achieves a CH4 Faradaic efficiency (FE) of 61.7% at -1.6 V vs. RHE, whereas Cu10CeOx favors C2 production with a maximum FE of 61.5% at -1.4 V vs. RHE. Mechanistic studies reveal that locally concentrated Cu sites exhibit strong *CO2 binding affinity, enhancing *CO surface coverage and facilitating *CO-*COH coupling. In contrast, Ce-Ov-rich regions with isolated copper centers supply abundant *H, promoting deep protonation of *CHO toward CH4. This work provides insights into catalyst design, demonstrating that manipulating structural chemistry can guide CO2RR toward targeted products.

SCIENCE CHINA Materials2026DOI: 10.1007/s40843-025-4057-4

Machine Learning-Assisted Rapid Development of High Performance Flexible Lead-Free Radiation Shielding Gels

The escalating use of ionizing radiation in medical and industrial applications necessitates lead-free, flexible, and sustainable shielding materials. Current development relies on empirical trial-and-error, which is inefficient. This study introduces a machine learning-assisted Monte Carlo simulation strategy for rapid optimization of metal filler compositions for X-ray attenuation across 40–120 kV. Guided by this AI-driven approach, polyvinyl alcohol (PVA)-based gels containing uniformly dispersed Bi/W/Gd2O3 nanoparticles were developed, forming within 1 minute at -20°C using a PVA-DMSO/H2O co-solvent system. The optimized gel with 50 wt% metal loading exhibits exceptional mechanical properties: tensile strength of 1.76 MPa, toughness of 6.3 MJ m−3, and elongation of 600%. It achieves >98% X-ray shielding efficiency at 5 mm thickness, outperforming lead composites at 120 kV. The physically cross-linked network provides recyclability and anti-freezing capability, retaining flexibility at -50°C. This work establishes a data-driven paradigm for designing high-performance radiation-shielding materials, demonstrating AI's potential to accelerate materials discovery and enable scalable fabrication of eco-friendly protective systems.

SCIENCE CHINA Materials2026DOI: 10.1007/s40843-025-4051-x

Bio-inspired synergistic interfacial anchoring for highly stable graphite lubricants

Graphite lubricants are critical for high-quality and high-efficiency drawing of refractory metal wires, yet inadequate dispersion stability frequently challenges their practical application. Inspired by the bio-surfactant synergic mechanism that combines different bio-surfactants to collectively reduce surface energy and friction, a binary anionic surfactant system comprising sodium dodecyl benzene sulfonate (SDBS) and sodium lignosulfonate (SL) was engineered to enhance dispersion and stability via a synergistic effect. The synergistic parameter β was calculated to be −2.34, indicating strong synergism. The resulting graphite lubricants maintained homogeneous dispersion for up to 60 days. Molecular dynamics (MD) simulations combined with density functional theory (DFT) calculations confirmed that the synergistic effects originate from steric hindrance, electrostatic repulsion, π-π stacking, and hydrogen bonding. These hierarchical secondary interactions collectively increased the interfacial formation energy at the graphite/surfactant/water tri-phase interface, thereby effectively wetting particle powders and enhancing stability. During metal wire drawing, the graphite lubricants reduced the friction coefficient between the die and metal wires to 0.06, ultimately enabling drawn tungsten wires with superior surface integrity, expanded loop diameter, and enhanced tensile strength relative to single-surfactant benchmarks. This study provides experimental and theoretical guidance to design effective graphite lubricants for high-quality drawn metal wires.

Journal of Fuel Chemistry and Technology2026DOI: 10.1016/S1872-5813(26)60708-6

Control Strategy for Mercury Emissions from Coal-Fired Flue Gas in China

Mercury emissions from coal combustion are highly toxic, volatile, and bioaccumulative, posing long-term threats to ecosystems and human health. This review systematically examines the current status and control policies of mercury emissions from coal combustion in China, analyzing distribution characteristics and transformation mechanisms during combustion, with emphasis on collaborative removal in pollution control devices after ultra-low emission retrofitting. A progressive strategy of 'synergistic enhancement–deep purification–resource recycling' is proposed, comprising three tiers: optimizing operational parameters of existing control systems to enhance synergistic mercury removal; developing efficient adsorption and catalytic oxidation technologies for industrial application; and advancing integrated mercury removal and recovery technologies, such as magnetosphere-based sorbents and recovery processes, focusing on high-value utilization. The paper also outlines future research directions aligned with international compliance and domestic environmental tax policies, providing theoretical and technical support for China's commitments to near-zero emissions of coal combustion pollutants.

SCIENCE CHINA Materials2026DOI: 10.1007/s40843-026-4181-6

Electronic regulation via d-p coupling between ruthenium nanoclusters and ReS2 nanosheets for enhanced green hydrogen production performance

Green hydrogen production via electrocatalytic water splitting is pivotal for sustainable energy, yet the high cost and scarcity of platinum (Pt) catalysts impede large-scale adoption. Ruthenium (Ru)-based materials emerge as promising alternatives, but their performance requires enhancement. Two-dimensional transition metal dichalcogenides (TMDs), particularly ReS2, offer intrinsic 1T' phase with good conductivity and stability, yet suffer from inert surfaces limiting water adsorption. Here, we report a heterostructure comprising Ru nanoclusters anchored on ReS2 nanosheets (Ru/ReS2) to modulate electronic structure via d-p coupling. This design enhances water dissociation kinetics and optimizes hydrogen adsorption free energy (ΔG_H*). The Ru/ReS2 catalyst exhibits superior hydrogen evolution reaction (HER) activity in acidic media, achieving an overpotential of 47 mV at 10 mA cm−2 and a Tafel slope of 38 mV dec−1, outperforming commercial Pt/C (overpotential 54 mV, Tafel slope 45 mV dec−1). Notably, it demonstrates exceptional stability, with negligible degradation after 10,000 cyclic voltammetry cycles, contrasting with Pt/C's 54 mV overpotential increase. Density functional theory calculations reveal that d-p coupling between Ru and ReS2 optimizes the electronic structure, facilitating water adsorption and dissociation. This work provides a rational strategy for designing efficient, durable, and cost-effective HER electrocatalysts for green hydrogen production.

SCIENCE CHINA Materials2026DOI: 10.1007/s40843-026-4196-x

A Critical Artifact in Aqueous Zinc-Ion Batteries: Charging under Aerial Oxidation Distorts Discharged-Cathode Characterization

Aqueous zinc-ion batteries (AZIBs) are promising for safe, low-cost energy storage, but accurate cathode characterization is essential for understanding their electrochemical behavior. This study identifies a critical artifact: routine air-drying of deeply discharged cathodes triggers spontaneous aerial oxidation, which distorts post-mortem analysis. Using NH4V4O10 (NVO) as a model cathode, we show that ex situ X-ray photoelectron spectroscopy (XPS) of discharged electrodes reveals only V4+/V5+ signals, with no detectable V3+, implying a theoretical capacity of only 245.5 mAh g−1, yet experimentally measured capacity reaches ~334.5 mAh g−1 at 0.2 A g−1. This discrepancy arises because air exposure during sample preparation oxidizes the reduced vanadium states, leading to a self-charging effect that recovers ~83% of capacity. Electrochemical re-oxidation (EO-NVO) is superior to aerial oxidation (AO-NVO), producing a stable, long-range ordered bulk structure with efficient Zn2+ transport channels, whereas aerial oxidation induces only superficial changes and structural disorder. These findings resolve a key analytical inconsistency and reveal a novel capacity-contribution pathway, with direct implications for accurate material assessment and advanced battery design.

SCIENCE CHINA Materials2025DOI: 10.1007/s40843-025-3384-9

Humanoid Robotics in Material and Chemistry Experiments

The integration of humanoid robotics into materials science and chemistry addresses persistent challenges in reproducibility, scalability, and adaptability within complex experimental workflows. Laboratory automation has evolved from mechanized systems for repetitive tasks to specialized platforms incorporating artificial intelligence for experimental optimization. However, existing technologies lack cognitive and physical versatility, limiting their ability to manage dynamic, multidisciplinary conditions. Budget cuts and closures of chemistry departments in the United Kingdom and the United States have reduced traditional research capacities, increasing reliance on automation. Humanoid robots combine precision automation with human-like adaptability, equipped with dynamic perception, real-time reasoning, and dexterous manipulation. In Shanghai, specialized training grounds focus on physical actions, visual and gaseous sensing, positioning the city as a hub for chemical and chemical engineering applications. Chinese government policies, including the Ministry of Industry and Information Technology's stipulation that by 2025 an initial innovation system for humanoid robots will be established with breakthroughs in brain, cerebellum, and limbs, and mass production achieved, and by 2027 technical innovation capacity significantly enhanced, project comprehensive mass production and commercialization by 2025. The evolution of laboratory automation emphasizes rapid growth of automation-related publications. Humanoid robotics represents the next frontier, integrating advanced sensing, motion control, and AI systems to support dynamic, multidisciplinary workflows. Deployment from controlled laboratory settings to full-scale industrial production lines presents cost and complexity challenges. Thorough training and validation covering safety protocols, unexpected scenarios, and operational best practices are essential prerequisites. A single humanoid robot might demand an initial investment for hardware and integration, offset over time if replacing multiple human operators. Round-the-clock operation and rapid reconfiguration underscore unique advantages. By bridging AI-driven design and hands-on experimentation, these systems enable faster, more reliable material discovery and transformative industrial applications. The emergence of humanoid robotics-driven experimentation systems addresses three persistent dilemmas: the gap between theory and experiment, rigidity of multidisciplinary workflows, and geographical constraints on innovation scalability. Supported by Chinese policies, especially in Shanghai, these systems integrate multimodal AI cognition, adaptive mechatronic control, and digital twins fused with the metaverse, enabling seamless transitions between computational design and physical validation. Anthropomorphic form ensures compatibility with conventional laboratory setups while introducing human-like flexibility for non-standard scenarios. Currently gaining traction as experimental agents, their importance will grow as research becomes increasingly automated, complex, and decentralized. Development trends point toward tighter integration with AI frameworks such as federated learning and reinforcement learning, improving collaborative knowledge acquisition across cloud laboratories. Future expectations include scalable deployment in chemical production, materials development, and smart manufacturing.

SCIENCE CHINA Materials2025DOI: 10.1007/s40843-025-3418-5

Funnel-shaped precursor engineering for high-performance flexible perovskite photodetectors

Flexible photodetector arrays are critical for artificial retina prosthetics, yet their performance is limited by electrode discontinuities and incomplete perovskite crystallization under mechanical stress. This study introduces a funnel-shaped precursor engineering strategy to fabricate high-performance flexible perovskite photodetectors. An ultrathin platinum electrode film (UTPF) of less than 10 nm thickness is deposited via radio frequency magnetron sputtering combined with angular ion beam polishing, achieving an ultra-smooth surface. A vapor deposition method with dynamically regulated evaporation rates produces a dense-gradient PbI2 precursor with a funnel-shaped vertical structure, facilitating CH3NH3I solution penetration and yielding a dense, uniform perovskite film with large grains and strong interfacial bonding to the UTPF. The resulting devices exhibit a high detectivity of 19.48×10^12 Jones, an on/off current ratio of 6.87×10^4, and retain 92.53% of the original photocurrent after 4000 bending cycles at large angles. Integrated 10×10 flexible photodetector arrays demonstrate uniform dark current and photocurrent, along with high imaging resolution, confirming reliable imaging capabilities. This work addresses the mechanical and crystallization bottlenecks of flexible perovskite photodetectors, offering a viable route for artificial retina and wearable optoelectronic applications.

SCIENCE CHINA Materials2025DOI: 10.1007/s40843-025-3382-4

Coordination-directed ternary MOF-on-MOF-derived bimetal phosphide-carbon nanomaterials for efficient overall water splitting

The development of efficient, durable, and cost-effective electrocatalysts for overall water splitting (OWS) is critical for sustainable hydrogen production. Noble metal-based catalysts (Pt, Ru, Ir) exhibit high activity but suffer from scarcity and poor stability, while transition metal-based alternatives often lack sufficient active site utilization and mass transport. This work presents a coordination-directed synthesis of a ternary MOF-on-MOF heterostructure (ZIF-67@MOF-74@PBA) that serves as a precursor for bimetallic CoFeP nanoparticles anchored on hierarchically porous carbon nanomaterials with in situ grown carbon nanotubes (CNTs). The resulting catalyst features hollow structures with high site exposure, efficient mass and charge transport pathways, and synergistic effects from multiple transition metals. In 1.0 M KOH, the catalyst achieves a hydrogen evolution reaction (HER) overpotential of 107 mV at 10 mA cm−2, an oxygen evolution reaction (OER) overpotential of 231 mV at 10 mA cm−2, and an overall water splitting voltage of 1.544 V at 10 mA cm−2, with remarkable long-term stability. Apparent activation energy measurements and density functional theory (DFT) calculations reveal that the in situ integration of bimetals and phosphorus doping enhance O–O coupling in the OER and optimize hydrogen adsorption/desorption in the HER. This synthesis strategy offers a versatile approach for designing multi-level MOF-on-MOF systems as high-performance electrocatalysts, addressing the limitations of conventional transition metal catalysts in industrial water electrolysis.

SCIENCE CHINA Materials2025DOI: 10.1007/s40843-025-3375-8

A self-powered artificial tactile perception system with self-protection functionality based on tellurene threshold switching memristor

Artificial tactile perception systems require efficient signal conversion and pulse encoding to emulate biological touch. Conventional CMOS-based approaches suffer from circuit complexity and high power consumption. This work demonstrates a two-dimensional tellurene (Te) threshold switching (TS) memristor with low high-resistance-state variation, enabling artificial nociceptive behavior and leaky integrate-and-fire (LIF) neuron emulation. The Te TS memristor exhibits abrupt resistance switching and low power consumption. By integrating this LIF neuron with a piezoelectric nanogenerator (PENG), a self-powered artificial tactile perception system is constructed. Under mechanical stimulation, the system demonstrates a self-protection function analogous to the hand retraction reflex. The bio-inspired architecture eliminates external power sources and reduces circuit overhead. Key performance metrics include stable threshold switching, low variation in high resistance state, and reliable spike encoding. This work validates the potential of 2D tellurene for next-generation bio-inspired electronics and human-machine interaction systems, offering a pathway toward energy-autonomous tactile sensing with intrinsic protection mechanisms.

SCIENCE CHINA Materials2025DOI: 10.1007/s40843-025-3415-3

Mechanistic insights into atomic-to-nanoscale synergistic electrocatalysis

The integration of multi-scale active sites has emerged as a strategy to overcome intrinsic limitations of individual components in electrocatalysis. Single-atom catalysts (SACs) enable maximum atomic utilization and well-defined coordination environments, while nanoparticles/clusters (NPs/CLs) deliver superior electronic adaptability. Their synergistic combination introduces complex interfacial interactions that significantly influence reaction pathways, intermediate transport, and microenvironment modulation, yet these effects remain insufficiently understood. This review systematically analyzes recent advances of NPs/CLs-SACs in electrocatalysis, focusing on the local reaction environment and coordinating reaction pathways. NPs/CLs-SACs systems enable unique optimization of electronic structures, stabilization/transport of key intermediates, and decoupling of multi-step reaction pathways. We classify and analyze three major synergistic catalytic modes: co-adsorption catalysis, tandem catalysis, and parallel adsorption for coupling reactions. Key challenges in synthesis, stability, and mechanism understanding are identified, with future directions for rational design of sustainable catalytic technologies. The analysis draws on 76 references, including recent works on Ru/W single atoms with Pt nanoparticles for alkaline hydrogen oxidation (Nat Commun, 2025), multicomponent ensembles for oxygen reduction (Angew Chem Int Ed, 2024), and Fe–N4 sites coupled with Fe3C nanoparticles for PEMFCs (Energy Environ Sci, 2024). These studies demonstrate that precise control over atomic-to-nanoscale interfaces can yield performance metrics unattainable by single-component systems, such as enhanced CO2-to-CO electrolysis at industrial current densities and pH-universal nitrate reduction to ammonia.

SCIENCE CHINA Materials2025DOI: 10.1007/s40843-025-3314-0

Printable Core-Shell Nanoparticles Empower Stable Biosensing

Wearable and implantable biosensors enable real-time monitoring of physiological parameters and biomarkers such as glucose, lactate, and hormones, but face persistent limitations in selectivity, operational lifespan, and scalable manufacturing. Molecularly imprinted polymers (MIPs) and Prussian blue analogues (PBAs) offer customizable recognition and redox activity, yet PBAs degrade over electrochemical cycling and MIPs suffer from imprecise binding-site optimization. Wang et al. (Nat. Mater., 2025, 24, 589–598) address these bottlenecks with printable core-shell nanoparticles comprising a nickel hexacyanoferrate (NiHCF) core and an MIP shell. The NiHCF core, synthesized via a citrate-assisted method, yields uniform nanocubes with low lattice strain due to nickel's small atomic radius, retaining 95% of its redox signal after 5000 electrochemical cycles—significantly outperforming conventional PBAs. Density functional theory (DFT) calculations guided monomer selection to ensure precise molecular complementarity within the MIP cavity, resolving inefficient molecular recognition. Formulated into an inkjet-printable ink, the MIP/NiHCF nanoparticles enable scalable, additive manufacturing of biosensors. This platform establishes a new benchmark for wearable and implantable health monitoring, though challenges remain in extending dynamic range to picomolar cytokines, ensuring long-term stability in complex biofluids, and validating performance across diverse populations. The integration of molecular imprinting, redox-active nanomaterials, and additive manufacturing provides a foundation for next-generation diagnostics and therapeutic interventions.

SCIENCE CHINA Materials2025DOI: 10.1007/s40843-025-3433-x

Photoactivated hydroxyl radical generators with highly efficient charge separation for oxygen-independent photodynamic therapy

The design of photosensitizers that generate hydroxyl radicals (·OH) from water and achieve efficient charge separation (CS) is critical for hypoxic tumor photodynamic therapy (PDT). However, such ·OH photo-generators are scarcely reported, particularly those based on simple D-π-A scaffolds. This work presents TPE-SPyCx@BSA, constructed via co-assembly of a series of D-π-A tetraphenylpyridine salts (TPE-SPyCx) with bovine serum albumin (BSA), which initiates photocatalytic water oxidation to ·OH and enables efficient charge separation for oxygen-independent PDT. Electron paramagnetic resonance (EPR) trapping confirmed high-efficiency ·OH generation, and isotope tracing experiments revealed that the oxygen source of ·OH originates exclusively from H2O. The calculated valence band (VB) potential of TPE-SPyCx@BSA meets the thermodynamic conditions for ·OH production via water oxidation. Transient absorption spectra deciphered that the charge-separated state is realized after co-assembly, ensuring electron transfer to generate ·OH via an oxygen-independent pathway. TPE-SPyCx@BSA exhibited superb photocytotoxicity even under severe anoxic conditions and excellent antitumor efficacy in in vivo mouse models. This work provides a strategy for constructing oxygen-independent photodynamic agents, opening an avenue for effective PDT against hypoxic tumors.

SCIENCE CHINA Materials2025DOI: 10.1007/s40843-025-3606-6

P-doping optimized electronic metal-support interaction in Os/WC boosts H* transfer for enhanced alkaline hydrogen evolution

Transition-metal carbides (TMCs) have emerged as promising alternatives to platinum-based catalysts in the electrocatalytic hydrogen evolution reaction (HER), showcasing substantial potential for sustainable energy applications. Herein, a rapid microwave-plasma-assisted synthesis strategy (60 s) is employed to fabricate phosphorus-doped tungsten carbide (WC) uniformly loaded with osmium (Os) nanoclusters (Os/P-WC). The resulting Os/P-WC catalyst exhibits exceptional HER performance, achieving a benchmark current density of 10 mA cm−2 with low overpotentials of 20, 51, and 11 mV in alkaline, acidic, and alkaline seawater electrolytes, respectively. Furthermore, it maintains stable operation for 100 h at both 10 and 500 mA cm−2 in alkaline electrolyte. In-situ Raman spectroscopy, in-situ electrochemical impedance spectroscopy (EIS), and hydrogen binding energy (HBE) experiments confirm that the electronic metal-support interaction (EMSI) generates electron-enriched Os active sites. These sites facilitate the adsorption and dissociation of water, optimize the adsorption and desorption of hydrogen intermediates (H*), and thereby significantly accelerate reaction kinetics. This work presents a novel design and synthesis strategy for developing highly active electrocatalysts with low precious metal loading for H2 evolution applications.