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Insight into structural control and enhanced stability of boron nanosphere reinforced PAM/HAN hydrogels 硼纳米球增强PAM/HAN水凝胶的结构控制及稳定性研究
IF 5.4 2区 化学 Q2 CHEMISTRY, PHYSICAL Pub Date : 2026-05-20 Epub Date: 2026-01-27 DOI: 10.1016/j.colsurfa.2026.139731
Shideng Yuan , Fengmin Li , Lingyu Su , Xuxue Zhang , Shiling Yuan
The safety, stability, and overall performance of hydroxylammonium nitrate (HAN)-based gel propellants were crucial for their application in rocket systems. However, HAN, as a high-energy ionic liquid, posed significant safety and storage challenges, further complicated by the common issue of difficult ignition in traditional gel propellants. We employed molecular dynamics (MD) simulations to investigate the microstructural formation mechanism, dynamic properties, and mechanical stability of B-nanosphere-enhanced PAM(polyacrylamide)/HAN hydrogels. Our findings demonstrated that the B nanosphere acted as a structural core, enhancing PAM cross-linking and suppressing particle aggregation. Increasing the boron content significantly raised viscosity and lowered the diffusion rate of energetic species, thereby intrinsically improving safety and storage characteristics. Interfacial analysis confirmed that the B surface enhanced the hydrogen-bond network between HAN ions, boosting energy density and combustion performance, which helped mitigate ignition difficulties. Furthermore, stretching simulations confirmed that the nanoparticle network hydrogel (NNH) entanglement mode provided superior mechanical stability compared to the nanocomposite (NC) mode. These results offered microscopic guidance for designing safer, more stable, and higher-performance energetic propellants.
硝酸羟铵(HAN)凝胶推进剂的安全性、稳定性和综合性能对其在火箭系统中的应用至关重要。然而,HAN作为一种高能离子液体,对安全性和储存提出了重大挑战,而传统凝胶推进剂普遍存在点火困难的问题使其进一步复杂化。采用分子动力学(MD)模拟研究了b纳米球增强PAM /HAN水凝胶的微观结构形成机制、动力学性能和力学稳定性。我们的研究结果表明,B纳米球作为结构核心,增强PAM交联并抑制颗粒聚集。硼含量的增加显著提高了含能物质的粘度,降低了含能物质的扩散速率,从而从本质上改善了安全性和储存特性。界面分析证实,B表面增强了HAN离子之间的氢键网络,提高了能量密度和燃烧性能,有助于减轻点火困难。此外,拉伸模拟证实,纳米颗粒网络水凝胶(NNH)纠缠模式比纳米复合材料(NC)模式具有更好的机械稳定性。这些结果为设计更安全、更稳定、性能更高的高能推进剂提供了微观指导。
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引用次数: 0
Interfacial mechanisms of 6PPD-quinone adsorption on metal-organic framework functionalized nanocellulose aerogels 金属-有机骨架功能化纳米纤维素气凝胶吸附6ppd -醌的界面机理
IF 5.4 2区 化学 Q2 CHEMISTRY, PHYSICAL Pub Date : 2026-05-20 Epub Date: 2026-01-29 DOI: 10.1016/j.colsurfa.2026.139762
Lei Miao , Wei Guo , Haitao Chen , Xiaozheng Sun
Understanding the interfacial adsorption pathways of tire‑derived contaminants on hybrid porous materials is critical for advancing colloid and interface science. Here, we design a hierarchically structured metal-organic framework (MOF)‑functionalized nanocellulose (MOF@NC) aerogel using dicarboxylic cellulose nanocrystal (DCN)‑mediated interfacial bridging, forming a chemically active and spatially interconnected adsorption network. The adsorption of 6PPD‑quinone was evaluated through kinetic, isotherm, and thermodynamic analyses, revealing rapid chemisorption consistent with a pseudo‑second‑order model and monolayer adsorption on energetically uniform sites following the Langmuir model, with a maximum adsorption capacity of 20.0 ± 0.5 mg g⁻¹ . The MOF@NC aerogel retained approximately 87.2 ± 2.4 % of its initial adsorption efficiency after five adsorption‑desorption cycles, demonstrating good interfacial stability and reusability. Spectroscopic analyses (FTIR, XPS, SEM‑EDS) identify multiple interfacial interactions, including amide‑bond formation, Lewis acid-base coordination with MOF Zr-oxo clusters, π–π stacking between aromatic domains, hydrogen bonding, and dispersive interactions. Complementary density functional theory (DFT) and reduced density gradient (RDG) reveal energetically favorable adsorption configurations, and pronounced electronic redistribution at the MOF-nanocellulose heterointerface. By integrating macroscopic adsorption behavior with molecular-level interfacial analysis, this work establishes a mechanism-oriented framework for interpreting adsorption at MOF-biopolymer hybrid interfaces, thereby advancing fundamental understanding of how hybrid colloidal interfaces govern the sequestration of aniline-derived contaminants beyond prior performance-focused studies.
了解轮胎衍生污染物在混合多孔材料上的界面吸附途径对于推进胶体和界面科学至关重要。在这里,我们设计了一种分层结构的金属有机框架(MOF)功能化纳米纤维素(MOF@NC)气凝胶,利用二羧基纤维素纳米晶体(DCN)介导的界面桥接,形成一个化学活性和空间互联的吸附网络。通过动力学、等温线和热力学分析对6PPD -醌的吸附进行了评价,揭示了符合伪二级模型的快速化学吸附和符合Langmuir模型的能量均匀位置的单层吸附,最大吸附量为20.0 ± 0.5 mg g⁻¹ 。经过5次吸附-解吸循环后,MOF@NC气凝胶保持了约87.2 ± 2.4 %的初始吸附效率,表现出良好的界面稳定性和可重复使用性。光谱分析(FTIR, XPS, SEM - EDS)鉴定出多种界面相互作用,包括酰胺键形成,与MOF Zr-oxo簇的Lewis酸碱配位,芳香域之间的π -π堆叠,氢键和色散相互作用。互补密度泛函理论(DFT)和还原密度梯度(RDG)揭示了mof -纳米纤维素异质界面上有利的能量吸附构型和明显的电子重分布。通过将宏观吸附行为与分子水平界面分析相结合,本研究建立了一个机制导向的框架,用于解释mof -生物聚合物杂化界面上的吸附,从而推进了对杂化胶体界面如何控制苯胺衍生污染物的吸附的基本理解,超越了先前以性能为重点的研究。
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引用次数: 0
Synergistically hydrophobic-cationic rough silica nanoparticles for enhancing wellbore stability via suppressing rock water imbibition 协同疏水-阳离子粗二氧化硅纳米颗粒,通过抑制岩石水吸积来提高井筒稳定性
IF 5.4 2区 化学 Q2 CHEMISTRY, PHYSICAL Pub Date : 2026-05-20 Epub Date: 2026-01-27 DOI: 10.1016/j.colsurfa.2026.139746
Juan He , Kaihe Lv , Xianbin Huang , Jinsheng Sun , Han Jia , Yabin Wang
To address wellbore instability arising from the spontaneous water imbibition of rocks in water-based drilling fluids, hydrophobic-cationic rough silica nanoparticles (HRSN) are prepared through a one-step synthesis. SEM, EDS mapping, FTIR, TG, and XPS analyses verify the successful preparation of HRSN. Wettability tests reveal that HRSN increases the contact angles of sandstone and shale surfaces to 154.0° and 124.1°, respectively, achieving a distinct shift from hydrophilic to hydrophobic surfaces. Rheology and filtration evaluations indicate that HRSN exerts negligible effects on fluid rheology while slightly lowering API fluid loss. Capillary rise experiments demonstrate that 0.5 % HRSN suppresses the rising height to −1.08, −1.09, and −1.00 cm for capillaries with inner diameters of 0.3 mm, 0.5 mm, and 1.0 mm, respectively. Core spontaneous imbibition experiments show that 0.5 % HRSN decreases the total mass of imbibed water in shale by 48.1 % and lowers the initial absorption rate to 52 % of that of untreated shale. The linear expansion and rolling recovery rates of 0.5 % HRSN are 37.6 % and 68.5 %, respectively. AFM measurements and three-dimensional ultra-depth digital microscope observations demonstrate that HRSN generates nano/micro-scale rough structures on the filter cake and rock surfaces, thereby strengthening surface hydrophobicity. Molecular dynamics simulations reveal that HRSN, through the synergistic interactions of hydrophobic chains and cationic functionalities, establishes a stable adsorption layer on montmorillonite surfaces, effectively restraining interfacial water aggregation and invasion. Overall, HRSN exhibits remarkable water inhibition performance even at low dosages, serving as a viable solution for strengthening the stability of wellbores in water-based drilling fluids.
为了解决水基钻井液中岩石自发吸水引起的井筒不稳定性问题,通过一步合成制备了疏水性阳离子粗粒二氧化硅纳米颗粒(HRSN)。SEM, EDS, FTIR, TG和XPS分析验证了HRSN的成功制备。润湿性测试表明,HRSN使砂岩和页岩表面的接触角分别增加到154.0°和124.1°,实现了从亲水性表面到疏水性表面的明显转变。流变学和过滤评价表明,HRSN对流体流变学的影响可以忽略不计,而略微降低了API的滤失。毛细管上升实验表明,对于内径为0.3 mm、0.5 mm和1.0 mm的毛细管,0.5 % HRSN对上升高度的抑制作用分别为- 1.08、- 1.09和- 1.00 cm。岩心自发渗吸实验表明,0.5 % HRSN使页岩吸水总质量降低48.1 %,初始吸收率降至未处理页岩的52 %。0.5 % HRSN的线性膨胀率和滚动回收率分别为37.6 %和68.5 %。AFM测量和三维超深度数码显微镜观察表明,HRSN在滤饼和岩石表面产生纳米/微米尺度的粗糙结构,从而增强了表面疏水性。分子动力学模拟表明,HRSN通过疏水链和阳离子官能团的协同作用,在蒙脱土表面建立了稳定的吸附层,有效抑制了界面水的聚集和侵入。总体而言,即使在低剂量下,HRSN也表现出出色的阻水性能,是增强水基钻井液中井筒稳定性的可行解决方案。
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引用次数: 0
A light-activatable CO-releasing hydrogel with synergistic antibacterial activity promotes infected wound healing 具有协同抗菌活性的光活化共释放水凝胶促进感染伤口愈合
IF 5.4 2区 化学 Q2 CHEMISTRY, PHYSICAL Pub Date : 2026-05-20 Epub Date: 2026-01-27 DOI: 10.1016/j.colsurfa.2026.139723
Jing Sun , Zhihao Huang , Jiajia Zhao , Yunfei Wang , Shuangshuang Gong , Chao Zhang , Sen Liu , Hao Zhang , Wei Ye
Bacterial colonization and secondary infection are critical concerns in impaired skin, necessitating advanced therapeutic approaches. Consequently, the development of wound dressings integrated with robust antibacterial and anti-inflammatory functionalities has emerged as a promising direction for the management of severe skin infections. In this study, we developed a biosafe nanocomposite hydrogel capable of precise carbon monoxide (CO) release under red light irradiation for wound therapy. The hydrogel was constructed by incorporating multifunctional Ag/Ag3PO4-doped porous graphitic carbon nitride (AgPCN) nanoparticles, surface-modified with polyethyleneimine (PEI) to enhance CO2 adsorption (forming AgPCN@PEI@CO2), into a chitosan matrix (denoted as APC-CS). Under 630 nm light exposure, AgPCN exhibits dual photothermal and photocatalytic functions. The photothermal effect induces localized heating, triggering the thermal desorption of CO2 from PEI, while its photocatalytic activity concurrently reduces the released CO2 to CO. This synergistic mechanism enables precise spatiotemporal control over CO release by adjusting irradiation parameters and nanoparticle doping levels. The APC-CS hydrogel demonstrates potent synergistic antibacterial activity through combined photothermal sterilization and CO-mediated antibacterial action. The nanocomposite hydrogel demonstrates robust multimodal anti-inflammatory and antibacterial efficacy, along with excellent biocompatibility, thereby significantly accelerating wound healing. This study presents a novel and controllable platform for CO delivery, underscoring its considerable potential for wound-dressing applications.
细菌定植和继发感染是受损皮肤的关键问题,需要先进的治疗方法。因此,开发具有强大抗菌和抗炎功能的伤口敷料已成为治疗严重皮肤感染的一个有希望的方向。在这项研究中,我们开发了一种生物安全的纳米复合水凝胶,能够在红光照射下精确释放一氧化碳(CO),用于伤口治疗。该水凝胶是通过将多功能Ag/ ag3po4掺杂的多孔石墨氮化碳(AgPCN)纳米颗粒,表面用聚乙烯亚胺(PEI)修饰以增强CO2吸附(形成AgPCN@PEI@CO2),加入壳聚糖基体(APC-CS)中构建而成的。在630 nm光照射下,AgPCN表现出光热和光催化双重功能。光热效应诱导局部加热,触发PEI对CO2的热解吸,而其光催化活性同时将释放的CO2还原为CO。这种协同机制可以通过调节辐照参数和纳米颗粒掺杂水平来精确控制CO的时空释放。APC-CS水凝胶通过光热杀菌和co介导的抗菌作用显示出强大的协同抗菌活性。纳米复合水凝胶具有强大的多模态抗炎和抗菌功效,以及良好的生物相容性,从而显著加速伤口愈合。本研究提出了一种新颖可控的一氧化碳输送平台,强调了其在伤口敷料应用中的巨大潜力。
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引用次数: 0
Visible-light-driven g-C3N4/MoS2 heterojunction membranes for synergistic photocatalysis and antifouling dye separation 可见光驱动g-C3N4/MoS2异质结膜的协同光催化和防污染料分离
IF 5.4 2区 化学 Q2 CHEMISTRY, PHYSICAL Pub Date : 2026-05-20 Epub Date: 2026-01-23 DOI: 10.1016/j.colsurfa.2026.139697
Mingmin Jia , Wenhao Cao , Qiuxia Chen , Zhiyi Xia , Shuo Shi , Mingzhi Zheng , Hengyang Mao , Meisheng Li , Yijiang Zhao , Dingliang Dai , Jianhao Qiu
In this study, a g-C3N4/MoS2 composite membrane was successfully fabricated via electrostatic interactions and vacuum-assisted self-assembly. The established heterojunction markedly enhanced charge separation, yielding superior visible-light photocatalytic activity with 95.5 % methylene blue degradation in 150 min. The membrane also demonstrated efficient dye separation (70.8 % rejection for carmine red; 66.7 % for malachite green) and notable antifouling properties, achieving a 74.9 % flux recovery after visible-light cleaning. This work presents a synergistic strategy for simultaneous photocatalytic degradation and membrane separation in advanced water treatment.
在本研究中,通过静电相互作用和真空辅助自组装成功制备了g-C3N4/MoS2复合膜。建立的异质结显著增强了电荷分离,产生了优异的可见光催化活性,在150 min内对亚甲蓝的降解率为95.5 %。该膜还显示出有效的染料分离(对胭脂红的去除率为70.8 %;对孔雀石绿的去除率为66.7 %)和显著的防污性能,在可见光清洗后的通量回收率为74.9 %。这项工作提出了一种协同策略,同时光催化降解和膜分离在深度水处理。
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引用次数: 0
Which structure-property-process relationships govern semi-solid extrusion 3D printing? A stepwise and multi-parametric optimization protocol for pharmaceutical applications 哪一种结构-性能-工艺关系支配着半固态挤压3D打印?一种用于制药应用的逐步多参数优化方案
IF 5.4 2区 化学 Q2 CHEMISTRY, PHYSICAL Pub Date : 2026-05-20 Epub Date: 2026-01-30 DOI: 10.1016/j.colsurfa.2026.139780
Sara Bom , Matilde Carvalho , Pedro Prazeres , Catarina Santos , Ana Margarida Martins , Helena Margarida Ribeiro , Joana Marto
Semi-solid extrusion 3D printing (SSE-3DP) emerges as a powerful technology for producing customized soft-matter pharmaceutical products. However, its implementation is limited by the lack of standardized, mechanistically grounded optimization strategies that address the multifactorial nature of printability. Herein, a stepwise and multi-parametric protocol is proposed to streamline the optimization of materials printed via SSE-3DP through a comprehensive structure–property–performance framework. Two gelatin-based model inks, differing in the content of PEG-40 hydrogenated castor oil (PEG40 HCO), were used to validate the approach. Rheology, texture, thermal-imaging and contact angle measurements were performed as part of the pre-printing workflow to elucidate ink structure and interfacial behavior, while width, length, collapse, pentagram and z-stack assays were carried out to optimize the 3DP quality in-process, and macro and scanning electron microscopy (SEM) imaging were introduced as post-characterization validation tools. Rheological analysis revealed that PEG40 HCO lowers the Sol–Gel crossover temperature, increases viscoelastic moduli and reduces creep compliance, indicating enhanced resistance to deformation during extrusion. These property changes translated into higher extrusion forces and increased susceptibility to clogging, quantitatively predicted by texture analysis (R² ≥ 0.94). Interfacial studies identified acrylic as the optimal printing bed. Line fidelity was primarily governed by print speed, while controlled porosity emerged from the coupled optimization of filament spacing and printing path design. SEM confirmed that PEG40 HCO induces mesoscale reorganization of the gelatin network, yielding improved mechanical stability and geometric fidelity. Overall, this work provides a comprehensive and adaptable framework for SSE-3DP, advancing material-process-design optimization in 13 steps.
半固态挤压3D打印(SSE-3DP)成为生产定制软物质制药产品的强大技术。然而,它的实施是有限的,缺乏标准化的,机械接地优化策略,以解决印刷性的多因素性质。在此基础上,提出了一种逐步的多参数优化方案,通过一个综合的结构-性能-性能框架来简化SSE-3DP打印材料的优化。采用两种不同PEG-40氢化蓖麻油(PEG40 HCO)含量的明胶基模型油墨来验证该方法。流变学、纹理、热成像和接触角测量作为打印前工作流程的一部分,用于阐明油墨结构和界面行为,同时进行宽度、长度、折叠、五角星和z堆叠分析以优化过程中的3d打印质量,并引入宏观和扫描电子显微镜(SEM)成像作为后期表征验证工具。流变学分析表明,PEG40 HCO降低了溶胶-凝胶交叉温度,增加了粘弹性模量,降低了蠕变柔度,表明在挤压过程中增强了抗变形能力。这些性能变化转化为更高的挤压力和增加的堵塞敏感性,通过织构分析定量预测(R²≥0.94)。界面研究确定丙烯酸是最佳的印刷床。线形保真度主要由打印速度决定,而孔隙度可控则由线材间距和打印路径设计的耦合优化决定。扫描电镜证实,PEG40 HCO诱导了明胶网络的中尺度重组,提高了机械稳定性和几何保真度。总的来说,这项工作为SSE-3DP提供了一个全面的、适应性强的框架,通过13个步骤推进了材料工艺设计优化。
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引用次数: 0
Colloidal characteristics and dispersion stability of ascorbate-zinc-isoleucinate triple chelated complex in fermented dairy matrix 抗坏血酸锌异亮氨酸三螯合物在发酵乳基质中的胶体特性及分散稳定性
IF 5.4 2区 化学 Q2 CHEMISTRY, PHYSICAL Pub Date : 2026-05-20 Epub Date: 2026-01-30 DOI: 10.1016/j.colsurfa.2026.139789
Andrey Blinov , Zafar Rekhman , Alexey Golik , Evgeniy Shaposhnikov , Artem Samovolov , Alina Askerova , Sergey Artyushin , Alexey Lodygin , Andrey Nagdalian
Zn deficiency is a major global health problem affecting over 2 billion people worldwide, so it is important to approach the issue of its highly effective delivery to the body. In this study, a zinc ascorbate isoleucinate (ZAI) triple chelate complex was synthesized and characterized for the first time. The optimal synthesis parameters for ZAI were determined to be: pH = 3–8, t = 25–65 °C, τ = 5–20 min. It was observed that fortifying milk with ZAI is effective at concentrations of ≤ 0.005 mol/L. Notably, at 0.005 mol/L ZAI, cfu value (1.55 ×106 in 1 mL) was higher than that of the control sample (0.8 ×106 in 1 mL), indicating a growth stimulation effect on lactic acid bacteria. During fermentation, there was a significant decrease in pH value (from 6.74 to 4.37), an increase in titratable acidity (from 22.52 to 110.41 °T) and viscosity (from 3.3 to 625.8 mPa·s). However, the experimental fermented dairy product with ZAI received the highest sensory score, whereas the fortified milk before fermentation scored the lowest score.
锌缺乏症是一个影响全球20多亿人的重大全球健康问题,因此解决锌高效输送到人体的问题非常重要。本文首次合成了一种抗坏血酸锌异亮氨酸(ZAI)三螯合物,并对其进行了表征。确定ZAI的最佳合成参数为:pH = 3-8,t = 25-65 °C, τ = 5-20 min。结果表明,在浓度≤ 0.005 mol/L时,用ZAI强化牛奶是有效的。值得注意的是,在0.005 mol/L ZAI时,cfu值(1 mL为1.55 ×106)高于对照样品(1 mL为0.8 ×106),表明其对乳酸菌有刺激生长的作用。发酵过程中,pH值从6.74下降到4.37,可滴定酸度从22.52上升到110.41°T,粘度从3.3上升到625.8 mPa·s。添加ZAI的发酵乳感官评分最高,发酵前的强化乳感官评分最低。
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引用次数: 0
Effects and mechanism of nFe-ZnO modified biochar combined with anaerobic granular sludge for U(VI) removal nFe-ZnO改性生物炭与厌氧颗粒污泥联合去除U(VI)的效果及机理
IF 5.4 2区 化学 Q2 CHEMISTRY, PHYSICAL Pub Date : 2026-05-20 Epub Date: 2026-01-29 DOI: 10.1016/j.colsurfa.2026.139755
Taotao Zeng , Qiqi Deng , Zhixiong Liu , Yao Yan , Qian Jiang , Haichao Sha
Under rainfall-induced leaching, uranium (U) tailings may readily release U(VI) into surrounding water bodies, posing significant ecological and human health risks. Current U(VI) remediation strategies mainly rely on material adsorption or biomineralization, whereas studies investigating the synergistic removal performance and underlying mechanisms of biochar-based systems coupled with anaerobic granular sludge (AnGS) remain limited. In this study, nFe–ZnO-modified kelp biochar (Fe–ZnO@BC) was synthesized and combined with AnGS to achieve efficient U(VI) removal. The results demonstrated that under optimal conditions—an initial U(VI) concentration of 80 mg/L, pH of 3, reaction temperature of 303 K, contact time of 24 h, Fe–ZnO@BC dosage of 0.1 g/L, and AnGS dosage of 3 g/L—the U(VI) removal efficiency reached 92.16 %, with a maximum adsorption capacity of 147.46 mg/g. Coexisting ions, including CO₃²⁻, SO₄²⁻, and PO₄³ ⁻, as well as organic matter such as humic acid (HA), inhibited U(VI) removal, among which SO₄²⁻ exerted the most pronounced inhibitory effect. Kinetic and thermodynamic analyses revealed that the U(VI) adsorption process conformed to the pseudo-second-order kinetic model and the Langmuir isotherm model. Characterization using SEM–EDS, FTIR, and XPS indicated that U(VI) removal was primarily driven by complexation with oxygen-containing functional groups, reduction mediated by Fe²⁺, and metal ion exchange. Microbial community analysis further showed that bacterial phyla, including Methanobacteriota, Pseudomonadota, and Atribacterota, along with dominant genera such as Dyella and Burkholderia–Caballeronia–Paraburkholderia, played key roles in U(VI) removal. In addition, reusability and desorption experiments demonstrated that the Fe–ZnO@BC/AnGS maintained U(VI) removal efficiencies above 80 % after five consecutive adsorption–desorption cycles. Overall, this study highlighted the strong potential of the Fe–ZnO@BC/AnGS system for the remediation of U(VI)-contaminated wastewater.
在降雨浸出过程中,铀(U)尾矿极易向周边水体释放铀(VI),对生态和人体健康构成重大风险。目前的U(VI)修复策略主要依赖于材料吸附或生物矿化,而对生物炭基系统与厌氧颗粒污泥(AnGS)的协同去除性能和潜在机制的研究仍然有限。本研究合成了nfe - zno修饰的海带生物炭(Fe - ZnO@BC),并与AnGS结合,实现了对U(VI)的高效脱除。结果表明,在初始U(VI)浓度为80 mg/L、pH为3、反应温度为303 K、接触时间为24 h、Fe - ZnO@BC用量为0.1 g/L、AnGS用量为3 g/L的最佳条件下,U(VI)的去除率可达92.16 %,最大吸附量为147.46 mg/g。同时存在的CO₃²⁻、SO₄²⁻和PO₄³ ⁻,以及腐殖酸(HA)等有机物对U(VI)的清除有抑制作用,其中SO₄²⁻的抑制作用最为明显。动力学和热力学分析表明,U(VI)吸附过程符合拟二级动力学模型和Langmuir等温模型。SEM-EDS、FTIR和XPS表征表明,U(VI)的去除主要由含氧官能团络合、Fe 2 +介导的还原和金属离子交换驱动。微生物群落分析进一步表明,甲烷菌门、假单胞菌门、门杆菌门以及优势菌门如Dyella、Burkholderia-Caballeronia-Paraburkholderia对U(VI)的去除起关键作用。此外,重复利用和解吸实验表明,Fe - ZnO@BC/AnGS在连续5次吸附-解吸循环后,U(VI)的去除率保持在80% %以上。总体而言,本研究强调了Fe - ZnO@BC/AnGS系统修复U(VI)污染废水的强大潜力。
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引用次数: 0
Multiplicative interaction model for optimum salinity in surfactant-alcohol-oil-water systems 表面活性剂-醇-油-水体系最佳矿化度的乘法相互作用模型
IF 5.4 2区 化学 Q2 CHEMISTRY, PHYSICAL Pub Date : 2026-05-20 Epub Date: 2026-01-25 DOI: 10.1016/j.colsurfa.2026.139707
Nijat R. Gasimli , Hanif F. Yoga , Hamid Emami-Meybodi , Russell T. Johns
Accurate estimation of the optimum salinity is critical in many applications, including the design of effective surfactant flooding formulations. Although alcohol improves surfactant solubilization and interfacial behavior, its role is often simplified in existing optimum salinity correlations. This paper introduces an optimum salinity model that explicitly accounts for the alcohol volume fraction in surfactant–alcohol mixtures through multiplicative interaction coefficients among key formulation variables, including oil alkane carbon number (ACN), temperature (T), and alcohol fraction (CA). We conducted over 120 salinity scans (48 primary and 72 repetitive scans) using sodium dodecyl sulfate (SDS) (4.29 wt%) and n-butanol (17.16 wt%, 10.73 wt%, and 8.58 wt%) with a series of pure alkanes (n-heptane, n-octane, n-decane, and n-dodecane) across four temperatures of 21, 30, 45, and 60°C at a fixed water-oil ratio of one. Optimum salinities (S*) were determined from unbiased linear fits of the inverse of the three-phase solubilization data. Linear relationships are observed between lnS* and ACN, T, and CA. Although relationships are linear, the slopes were not always constant as other formulation variables changed, indicating potential interactions among CA, ACN, and T. Accordingly, we developed a multiplicative interaction model for optimum salinity, including all interaction terms to account for potential synergistic behavior. The results show a significant interaction between CA and ACN and a slight-to-moderate interaction between CA and T. All other interactions were negligible. Including these interactions improves the global fit of measured optimum salinity data by 23 % compared to the conventional linear additive model. Furthermore, errors of 100 % in the estimated optimum salinity are possible for alcohol fractions outside the range of experimental data.
在许多应用中,准确估计最佳矿化度是至关重要的,包括设计有效的表面活性剂驱配方。虽然醇改善了表面活性剂的增溶作用和界面行为,但它的作用在现有的最佳盐度相关性中往往被简化。本文介绍了一个最佳盐度模型,该模型通过关键配方变量(包括油烷烃碳数(ACN)、温度(T)和酒精分数(CA))之间的乘法相互作用系数,明确地说明了表面活性剂-酒精混合物中的酒精体积分数。我们使用十二烷基硫酸钠(SDS)(4.29 wt%)和正丁醇(17.16 wt%, 10.73 wt%和8.58 wt%)对一系列纯烷烃(正庚烷,正辛烷,正癸烷和正十二烷)进行了120多次盐度扫描(48次一次扫描和72次重复扫描),温度为21、30、45和60°C,固定水油比为1。最佳盐度(S*)由三相增溶数据逆的无偏线性拟合确定。在lnS*与ACN、T和CA之间观察到线性关系。虽然关系是线性的,但随着其他公式变量的变化,斜率并不总是恒定的,这表明CA、ACN和T之间存在潜在的相互作用。因此,我们开发了一个乘法相互作用模型,用于最佳盐度,包括所有相互作用项,以解释潜在的协同行为。结果表明,CA和ACN之间有显著的相互作用,CA和t之间有轻微到中度的相互作用,其他相互作用都可以忽略不计。与传统的线性加性模型相比,包括这些相互作用可将测量的最佳盐度数据的全局拟合提高23% %。此外,对于实验数据范围之外的酒精馏分,估计的最佳盐度可能有100%的误差。
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引用次数: 0
Constrain nickel bicarbonate within Ni-modified graphitized carbonized wood for efficient urea electro-oxidation 在镍改性石墨化碳化木材中约束碳酸氢镍,以实现高效的尿素电氧化
IF 5.4 2区 化学 Q2 CHEMISTRY, PHYSICAL Pub Date : 2026-05-20 Epub Date: 2026-02-08 DOI: 10.1016/j.colsurfa.2026.139889
Jixin Peng , Can Sheng , Xinya Ye , Han Xu , Duping Wang , Kang Xu , Yuanyuan Liao , Yan Qing , Yiqiang Wu
The practical implementation of urea oxidation reaction (UOR) for energy-saving hydrogen generation is hindered by the lack of efficient and robust non-precious electrocatalysts. Herein, we design a novel hybrid catalyst comprising nickel bicarbonate anchored on a Ni-modified graphitized carbonized wood substrate (Ni(HCO3)2-Ni/GCW). This architecture effectively overcomes the inherent kinetic limitations and stability challenges of UOR. The hierarchical porous network of the wood-derived carbon facilitates superior mass transport and exposes numerous sites for catalyst loading. Advanced characterization and density functional theory computations uncover the pivotal role of carbonate groups in Ni(HCO3)2, which function as non-innocent ligands to strengthen urea adsorption and ease CO2 product release, thereby significantly elevating UOR activity. Ni(HCO3)2-Ni/GCW combines a low UOR potential of 1.34 V (vs. RHE at 50 mA·cm−2) with outstanding operational stability. When assembled for overall urea splitting, the Pt/C||Ni(HCO3)2-Ni/GCW electrolyzer operates at 1.59 V to deliver 50 mA·cm−2, achieving a notable 230 mV reduction in the cell voltage relative to conventional water splitting (1.82 V). This research establishes a new paradigm for engineering stable and highly active UOR catalysts through the strategic integration of functional materials with renewable biomass-derived scaffolds.
由于缺乏高效、稳定的非贵重电催化剂,阻碍了尿素氧化反应节能制氢的实际实施。在此,我们设计了一种新型的混合催化剂,该催化剂由碳酸氢镍锚定在镍改性的石墨化碳化木材基体(Ni(HCO3)2-Ni/GCW)上。这种结构有效地克服了UOR固有的动力学限制和稳定性挑战。木材衍生碳的分层多孔网络促进了优越的质量运输,并暴露了许多催化剂负载的场所。先进的表征和密度功能理论计算揭示了碳酸盐基团在Ni(HCO3)2中的关键作用,它们作为非无害配体加强尿素吸附和减缓CO2产物释放,从而显著提高UOR活性。Ni(HCO3)2-Ni/GCW结合了1.34 V的低UOR电位(相对于50 mA·cm−2的RHE)和出色的操作稳定性。当组装用于整体尿素分解时,Pt/C||Ni(HCO3)2-Ni/GCW电解槽在1.59 V下工作,输出50 mA·cm - 2,相对于传统的水分解(1.82 V),电池电压显著降低230 mV。本研究通过功能材料与可再生生物质衍生支架的战略性整合,为工程稳定和高活性的UOR催化剂建立了新的范例。
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Colloids and Surfaces A: Physicochemical and Engineering Aspects
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