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XW
Verified CAS / Academic Author6 Decoded Studies

Prof. Xuefei Wu

Chongqing University

Co-Affiliations:School of Civil Engineering and Architecture, Anhui University of TechnologyNot explicitly stated in the provided text; likely Chinese Academy of Sciences or a university.

Research Publications & English Decoded Briefs

Showing 6 publications
SCIENCE CHINA Materials2026DOI: 10.1007/s40843-025-3605-0

Enhancing NiOx Hole Transport Properties through Planarity Modulation of Organic Small Molecules for Inverted Perovskite Solar Cells

Nickel oxide (NiOx) is widely used as a hole transport material in inverted perovskite solar cells (PSCs). However, its practical application is limited by low intrinsic conductivity and insufficient hole extraction ability, leading to significant interfacial defects that reduce device efficiency and stability. To overcome these issues, two isomeric small organic molecules, 2,6-NOT and 1,5-NOT, were developed and introduced to modify NiOx. These isomers share the same structure but differ in the substitution positions of functional groups, resulting in distinct molecular planarity. Experimental results demonstrate that 1,5-NOT, featuring extended conjugation and enhanced planarity, more effectively enhances the hole extraction/transport capabilities and conductivity of NiOx compared to 2,6-NOT. The NiOx/1,5-NOT-based device achieves a remarkable power conversion efficiency (PCE) of 24.20%, along with excellent long-term stability, surpassing the NiOx control device (18.12%) and the 2,6-NOT-based device (21.87%). These findings indicate that modifying NiOx with small organic molecules significantly improves charge transport performance, and increasing molecular planarity is particularly beneficial for enhancing hole transport and reducing defect density, thereby increasing both efficiency and stability. This work provides a new strategy for NiOx modification via small organic molecules, offering a promising route to high-performance inverted PSCs.

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.

The Chinese Journal of Process Engineering2026DOI: 10.12034/j.issn.1009-606X.225204

Activation of Peroxymonosulfate-Based Advanced Oxidation via Co@Si-A for Tetracycline Degradation: Performance and Mechanism

Cobalt-doped silica aerogel (Co@Si-A) catalysts were synthesized via a one-step sol-gel method and applied for peroxymonosulfate (PMS) activation to degrade tetracycline (TC). The catalyst with 25 wt% cobalt doping (25Co@Si-A) exhibited superior catalytic performance, achieving 98.97% TC degradation within 30 min under specified conditions (TC 10 mg/L, 100 mL). Brunauer-Emmett-Teller (BET) analysis revealed a high specific surface area and well-developed porous architecture with nano-confined spaces. The 25Co@Si-A/PMS system demonstrated outstanding adaptability across a broad pH range (5–9), maintaining >95% degradation efficiency, and showed strong resistance to sulfate and nitrate ions. In real water matrices, degradation efficiency remained around 80%. After five consecutive cycles, the system retained 82.33% degradation efficiency, with cobalt ion leaching of only 23.7 μg/L in the first cycle, indicating excellent stability. Mechanistic studies using electron paramagnetic resonance (EPR), radical quenching, and probe compound tests confirmed a synergistic radical and non-radical pathway. The primary reactive species were sulfate radicals (SO4•−), hydroxyl radicals (•OH), and singlet oxygen (1O2), with contributions of 58.53%, 9.79%, and 31.68%, respectively. Electrochemical tests indicated that 25Co@Si-A exhibited superior charge transfer compared to Co3O4, attributed to the nano-confined effect of the silica aerogel, which enhanced Co(II)/Co(III) redox cycling and PMS activation. This research provides a promising strategy for utilizing silica aerogel-based catalysts in advanced oxidation processes for water treatment.

Chinese Journal of Environmental Engineering2026DOI: 10.12030/j.cjee.202508084

Mechanical Properties and Pore-Forming Mechanism of Porous Ceramsite Prepared from Multi-Source Granite Solid Waste

Granite mining areas generate large quantities of abandoned soil and rock powder, posing environmental challenges and resource waste. This study investigates the synergistic preparation of porous ceramsite from two typical granite solid wastes—weathered granite soil (high Al2O3) and granite waste rock powder (high SiO2)—with waste glass powder as a fluxing agent. Single-factor experiments and response surface methodology (Box-Behnken) were employed to optimize the process and elucidate the pore-forming mechanism. The optimal conditions were a mass ratio of weathered granite soil:granite waste rock powder:waste glass powder of 5.6:2.4:2, a preheating temperature of 480 °C, a sintering time of 32 min, and a sintering temperature of 1140 °C. Under these conditions, the resulting porous ceramsite achieved a compressive strength of 1.74 MPa. The ceramsite effectively immobilized heavy metals, ensuring environmental safety. This research demonstrates that multi-component complementarity and multi-factor coupling optimization can produce porous ceramsite with favorable mechanical properties and stable pore structure, providing a theoretical basis and technical support for high-value utilization of granite solid waste.

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.

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.