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Kinetics of Monomolecular Adsorption from Solutions. Approximation and Molecular Kinetic Analysis 溶液中单分子吸附动力学。近似与分子动力学分析
IF 0.8 4区 材料科学 Q3 METALLURGY & METALLURGICAL ENGINEERING Pub Date : 2025-11-18 DOI: 10.1134/S2070205125700522
O. D. Linnikov

The pseudo-first and pseudo-second order equations used to describe the kinetics of adsorption in solutions are considered. It is shown that they are mainly empirical approximating equations. Based on the mathematical analogy with adsorption isotherms, new expressions for approximating kinetic adsorption curves are proposed. Molecular kinetic analysis of monomolecular adsorption in solutions was performed. A new model of this process has been obtained, taking into account the influence of temperature, hydrodynamics, and other factors on its kinetics. As a consequence, the proposed model yields the Langmuir equation and a number of expressions that allow one to calculate the value of equilibrium adsorption, as well as to estimate the parameters of the adsorption process based on data on its kinetics. It is shown that the integral form of the pseudo-second order equation is also a consequence of the proposed molecular kinetic model. A comparison was made with experimental data on the kinetics of adsorption in solutions published in the literature.

考虑了用于描述溶液中吸附动力学的拟一阶和拟二阶方程。结果表明,它们主要是经验逼近方程。通过与吸附等温线的数学类比,提出了新的吸附动力学曲线近似表达式。对溶液中的单分子吸附进行了分子动力学分析。考虑温度、流体力学和其他因素对其动力学的影响,建立了该过程的新模型。因此,提出的模型产生了Langmuir方程和一些表达式,这些表达式允许人们计算平衡吸附的值,以及根据其动力学数据估计吸附过程的参数。伪二阶方程的积分形式也是所提出的分子动力学模型的结果。并与文献中发表的溶液吸附动力学实验数据进行了比较。
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引用次数: 0
A Catalyst Based on a Macroheterocyclic Mn Compound and Modified CNTs for an Alkaline Hydrogen–Air Fuel Cell 基于大杂环Mn化合物和改性碳纳米管的碱性氢空气燃料电池催化剂
IF 0.8 4区 材料科学 Q3 METALLURGY & METALLURGICAL ENGINEERING Pub Date : 2025-11-18 DOI: 10.1134/S2070205125700510
A. V. Kuzov, V. V. Emets, M. V. Radina, O. V. Korchagin, V. N. Andreev

A new catalytic system based on manganese phthalocyanine and nitrogen-doped carbon nanotubes (CNTNs) was synthesized and studied as a platinum-free electrocatalyst in the oxygen reduction reaction (ORR) in an alkaline medium. The synthesized MnPc/CNTN electrocatalyst showed high activity in the ORR both under model conditions using a rotating disk electrode and as part of an alkaline fuel cell (AFC) with a membrane-electrode assembly (MEA) with an anion-exchange membrane. Results obtained were compared with a commercial monoplatinum catalyst’s characteristics under the same conditions. The maximum power density values were 30 and 51 mW/cm2 for an MEA with 60Pt/C and MnPc/CNTN, respectively. It has been shown that the MnPc/CNTN system under the operating conditions of an AFC with an MEA is characterized by a higher tolerance to toxic agents (including the ionomer) than the platinum catalyst, which is an important advantage of an MEA based on MnPc/CNTs.

合成了一种基于酞菁锰和氮掺杂碳纳米管(CNTNs)的新型催化体系,并对其在碱性介质中氧还原反应(ORR)中的无铂电催化剂进行了研究。合成的MnPc/CNTN电催化剂在ORR中表现出较高的活性,无论是在旋转圆盘电极的模型条件下,还是作为带有阴离子交换膜的膜电极组件(MEA)的碱性燃料电池(AFC)的一部分。所得结果与相同条件下的商品单铂催化剂的性能进行了比较。60Pt/C和MnPc/CNTN的最大功率密度值分别为30和51 mW/cm2。研究表明,与铂催化剂相比,在带有MEA的AFC运行条件下,MnPc/CNTN体系对有毒物质(包括离聚体)的耐受性更高,这是基于MnPc/CNTs的MEA的一个重要优势。
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引用次数: 0
The Effect of the Surface of a Metal on the Physicochemical and Physicomechanical Properties of Latex Polyacrylates. 1. Polymer Compositions 金属表面对乳胶聚丙烯酸酯物理化学和物理力学性能的影响。聚合物组成
IF 0.8 4区 材料科学 Q3 METALLURGY & METALLURGICAL ENGINEERING Pub Date : 2025-11-18 DOI: 10.1134/S2070205125700431
T. R. Aslamazova, V. A. Kotenev, V. A. Lomovskoi

The results of studies of the effect of metals on the physicochemical and physicomechanical properties of polyacrylates based on the analysis of the energy characteristics of the polymer are generalized. For this purpose, the effect of introduced into a polymer composition highly dispersed metal/metal-containing inorganic fillers on the relaxation behavior of the polymers is studied. An analysis of the properties of polyacrylates with different elasticities in the presence of a metal was performed based on the internal friction spectra and temperature–frequency dependences of the oscillatory process of a composite that are obtained using dynamic relaxation spectroscopy based on the determination of the temperature regions of materialization of the elastic properties of a composite at –150 to 100°C. The results of studies of the effect of metal powders of iron and zinc and zinc oxide on the physicochemical and physicomechanical properties of acrylic elastomers are presented and generalized versus an unfilled polymer.

在分析聚丙烯酸酯的能量特性的基础上,总结了金属对聚丙烯酸酯的物理化学和物理力学性能影响的研究结果。为此,研究了在聚合物组合物中引入高度分散的金属/含金属无机填料对聚合物弛豫行为的影响。利用动态弛豫谱法测定复合材料弹性性能在-150 ~ 100℃的物化温度区域,得到复合材料的内摩擦谱和振荡过程的温度-频率依赖关系,分析了金属存在下具有不同弹性的聚丙烯酸酯的性能。介绍了铁锌金属粉末和氧化锌对丙烯酸弹性体物理化学和物理力学性能影响的研究结果,并与未填充的聚合物进行了推广。
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引用次数: 0
The Photoelectrocatalytic Activity of Thin-Film WO3 Photoanodes 薄膜WO3光阳极的光电催化活性
IF 0.8 4区 材料科学 Q3 METALLURGY & METALLURGICAL ENGINEERING Pub Date : 2025-11-18 DOI: 10.1134/S2070205125700479
V. V. Emets, V. A. Grinberg, A. A. Averin, A. A. Shiryaev

Thin films of tungsten oxide were obtained by cathodic electrodeposition from an electrolyte based on sodium tungstate at a potential of –0.45 V versus an Ag/AgCl reference electrode. WO3 photoanode film consists of a monoclinic modification (ε-WO3) with a crystallite size of 10–12 nm. The electrocatalytic activity of WO3 photoanode in reactions of photoelectrochemical oxidation of mono-, di-, and trihydric alcohols was studied. It was shown that the photoelectrocatalytic activity of WO3 photoanodes is explained by an increase in the photoelectrooxidation rate symbatically with the number of alcohol adsorption sites.

以钨酸钠为基料,在-0.45 V电位下与Ag/AgCl参比电极进行阴极电沉积,得到氧化钨薄膜。WO3光阳极膜为单斜晶型(ε-WO3),晶粒尺寸为10 ~ 12 nm。研究了WO3光阳极在一醇、二醇和三醇电化学氧化反应中的电催化活性。结果表明,WO3光阳极的光电催化活性与乙醇吸附位点数目的增加成正比关系。
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引用次数: 0
Topography, Mechanical Performance, and Corrosion Resistance of Multilayer Ti/CrN/TiN Coatings Prepared by Cathodic Arc Deposition under Varying Substrate Bias 阴极电弧沉积制备Ti/CrN/TiN多层涂层的形貌、力学性能和耐蚀性
IF 0.8 4区 材料科学 Q3 METALLURGY & METALLURGICAL ENGINEERING Pub Date : 2025-11-18 DOI: 10.1134/S2070205125700467
Wu Van Huy, N. B. Rodionov, V. A. Karpov, Ngo Thanh Binh, Nguyen Dang Khoa, Vu Thi Lan Vi

Ti/CrN/TiN coatings were deposited by cathodic arc deposition at substrate bias voltages ranging from 20 to 60 V. The study examined the effect of bias voltage on the topography and the mechanical and corrosion properties of the coatings using laser and scanning electron microscopy, X-ray diffraction, nanohardness testing equipment and electrochemical testing. The results show that bias voltage significantly affects the morphology of Ti/CrN/TiN coatings. With an increase in bias voltage from 20 to 60 V, the concentration of macroscopic defects decreased significantly, and average surface roughness Ra, measured by the contact method, decreased from 0.227 to 0.179 μm per 4 mm of length. Nanoindentation showed that coatings deposited at a bias voltage of 60 V have maximum hardness and elastic modulus. Corrosion tests in 3.5 wt % NaCl solution showed that coatings deposited at 20- and 40-V bias voltages had better corrosion resistance than coatings deposited at 60 V, probably due to a denser microstructure acting as a barrier to the diffusion of aggressive substances.

采用阴极电弧沉积技术,在20 ~ 60 V的衬底偏置电压下沉积Ti/CrN/TiN镀层。采用激光、扫描电镜、x射线衍射、纳米硬度测试设备和电化学测试等方法研究了偏置电压对镀层形貌、力学性能和腐蚀性能的影响。结果表明,偏置电压对Ti/CrN/TiN镀层的形貌有显著影响。当偏置电压从20 V增加到60 V时,宏观缺陷浓度显著降低,接触法测量的平均表面粗糙度Ra从0.227 μm / 4 mm降低到0.179 μm / 4 mm。纳米压痕表明,在偏置电压为60 V时,涂层具有最大的硬度和弹性模量。在3.5 wt % NaCl溶液中的腐蚀试验表明,在20和40 V偏置电压下沉积的涂层比在60 V偏置电压下沉积的涂层具有更好的耐腐蚀性,这可能是由于致密的微观结构对侵蚀性物质的扩散起了屏障作用。
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引用次数: 0
The Effect of the Surface of a Metal on the Physicochemical and Physicomechanical Properties of Latex Polyacrylates. 2. Polymer Coatings 金属表面对乳胶聚丙烯酸酯的物理化学和物理力学性能的影响。聚合物涂层
IF 0.8 4区 材料科学 Q3 METALLURGY & METALLURGICAL ENGINEERING Pub Date : 2025-11-18 DOI: 10.1134/S2070205125700443
T. R. Aslamazova, V. A. Kotenev, V. A. Lomovskoi

Data on the effect of a metal substrate on the physicochemical and physicomechanical properties of polyacrylate coatings are generalized taking into account the energy characteristics of the metal and relaxation behavior of the polymer. An analysis of the properties of polyacrylates with different elasticities in the presence of a metal is based on the experimental data on the internal friction spectra and temperature–frequency dependences of the oscillatory process obtained using dynamic relaxation spectroscopy based on the determination of the temperature regions of materialization of the elastic properties of the polymer at from −150 to 100°C. To confirm the effect of the characteristics of the metal surface on the physicomechanical properties of the film-forming polymer, this paper generalizes the data of the works of the authors, in which the characteristic features of the occurrence of dissipative processes in film-forming latex polyacrylates localized on metal substrates of different chemical natures are analyzed taking into account their surface energy.

考虑到金属的能量特性和聚合物的弛豫行为,对金属基材对聚丙烯酸酯涂层的物理化学和物理力学性能影响的数据进行了概括。利用动态弛豫光谱法测定了聚合物弹性性能在- 150 ~ 100℃之间的物化温度区域,得到了内摩擦谱和振荡过程的温度-频率依赖关系的实验数据,分析了在金属存在下具有不同弹性的聚丙烯酸酯的性能。为了确定金属表面特性对成膜聚合物的物理力学性能的影响,本文总结了作者的工作数据,分析了不同化学性质的金属基体上的成膜乳胶聚丙烯酸酯耗散过程发生的特征特征,并考虑了它们的表面能。
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引用次数: 0
Predictive Modeling of the Photochromism of Amphiphilic Spironaphthoxazines in Organic Solvents 两亲性螺萘恶嗪类化合物在有机溶剂中光致变色的预测模型
IF 0.8 4区 材料科学 Q3 METALLURGY & METALLURGICAL ENGINEERING Pub Date : 2025-11-18 DOI: 10.1134/S207020512570056X
Yu. M. Selivantyev, N. Yu. Spitsyn, A. N. Morozov, V. S. Mityanov, A. V. Kutasevich, V. V. Novikova, O. A. Raitman

This paper presents the results of quantum-chemical modeling and experimental study of the optical properties of amphiphilic spironaphthoxazines in organic solvents. For the first time, a predictive model has been developed for calculating the spectral characteristics of photochromes of this class. It is shown that taking into account multiconfigurational interaction by the CASSCF method allows obtaining information about the complex nature of photo-induced electronic transitions in spironaphthoxazines.

本文介绍了两亲性螺萘恶嗪类化合物在有机溶剂中光学性质的量子化学模拟和实验研究结果。本文首次建立了计算这类光致变色材料光谱特性的预测模型。研究表明,通过CASSCF方法考虑多构型相互作用,可以获得有关螺旋萘恶嗪中光诱导电子跃迁的复杂性质的信息。
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引用次数: 0
Equilibrium Sorption of Phenol from Aqueous Solutions by Activated Carbons Based on Various Raw Materials 不同原料活性炭平衡吸附苯酚的研究
IF 0.8 4区 材料科学 Q3 METALLURGY & METALLURGICAL ENGINEERING Pub Date : 2025-11-18 DOI: 10.1134/S2070205125700492
Yu. A. Kolesova, I. V. Voronyuk, T. V. Eliseeva

This paper studies phenol sorption on VSK-400 and Norit GAC 1240W activated carbons obtained from various raw materials at different temperatures under static conditions. Sorption capacity for a number of inorganic substances is determined, indicating the number of functional acid and basic groups, and also giving a preliminary characteristic of the surface area of sorbents by the amount of adsorbed molecular iodine. Surface morphology of carbon particles from various raw materials is assessed using microphotographs obtained by scanning electron microscopy. When comparing the equilibrium characteristics in the studied concentration range, a greater ability to extract phenol for VSK-400 carbon is noted. At the same time, its sorption characteristics are not affected by temperature and the presence of mineral salt.

在静态条件下,研究了由不同原料制备的VSK-400和Norit GAC 1240W活性炭在不同温度下对苯酚的吸附性能。对许多无机物的吸附能力是确定的,表明功能酸和碱性基团的数量,并通过吸附分子碘的量给出吸附剂表面积的初步特征。使用扫描电子显微镜获得的显微照片评估来自各种原材料的碳颗粒的表面形貌。当比较所研究浓度范围内的平衡特性时,注意到VSK-400碳提取苯酚的能力更大。同时,其吸附特性不受温度和无机盐存在的影响。
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引用次数: 0
Chemical Modification of Cycloaliphatic Epoxy Matrix for Development of Anticorrosion Coatings 环脂肪族环氧基的化学改性及其在防腐涂料中的应用
IF 0.8 4区 材料科学 Q3 METALLURGY & METALLURGICAL ENGINEERING Pub Date : 2025-11-18 DOI: 10.1134/S2070205125700455
N. K. Golubeva, T. A. Kochina, A. G. Ivanova, Nguyen Van Chi

In this work, nine new binder compositions were synthesized based on a cycloaliphatic epoxy matrix (EP) modified with methylene diphenyl diisocyanate (MDI) and polydimethylsiloxane rubber (PDMS) with different ratios of components. The modification of the composition was confirmed by IR and NMR spectroscopy. A correlation was established between hardness, contact angle and coating composition based on binder data. Fillers such as muscovite mica and titanium dioxide were introduced into the composition of the developed binders to evaluate the physical and mechanical properties of the coatings. The influence of curing conditions (hardener, curing temperature) on the physical and mechanical properties of the coating was studied. The corrosion resistance of coatings was assessed using electrochemical methods. The weather resistance of the filled composition EP-10MDI-10PDMS was studied under humid tropical climate conditions. The coating composition is EP-10MDI-10PDMS with fillers (muscovite mica, ({text{Ti}}{{{text{O}}}_{2}})) previously synthesized biologically active substances ({text{Cu}}left( {{text{II}}} right)), ({text{Zn}}left( {{text{II}}} right),) and ({text{Co}}left( {{text{II}}} right)) complexes of tris(2-hydroxyethyl)amine (hydrometallatranes) were also introduced to enhance antifouling properties and their evaluation in the natural conditions of Nha Trang Bay (Dam Bai Bay).

以亚甲基二苯基二异氰酸酯(MDI)和聚二甲基硅氧烷橡胶(PDMS)为改性原料,以环脂肪族环氧基(EP)为基材,按不同配比对其进行改性,合成了9种新型粘结剂。通过红外光谱和核磁共振谱分析证实了该化合物的改性。根据粘结剂数据,建立了硬度、接触角与涂层成分之间的相关性。采用白云母、云母、二氧化钛等填料对涂料的物理力学性能进行了评价。研究了固化条件(硬化剂、固化温度)对涂层物理力学性能的影响。用电化学方法评价了涂层的耐蚀性。研究了填充组合物EP-10MDI-10PDMS在潮湿热带气候条件下的耐候性。以ep10mdi - 10pdms为涂层组成,填料为白云母,({text{Ti}}{{{text{O}}}_{2}})),并引入已有生物活性物质({text{Cu}}left( {{text{II}}} right))、({text{Zn}}left( {{text{II}}} right),)和({text{Co}}left( {{text{II}}} right))三(2-羟乙基)胺(hydrometallatranes)配合物,提高其防污性能,并对其在芽庄湾(坝白湾)自然条件下的性能进行评价。
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引用次数: 0
Structure and Properties of Electrochemically Deposited Nickel–Boron Coatings Modified with Protective Gold–Cobalt Film 金-钴保护膜改性电化学沉积镍硼涂层的结构与性能
IF 0.8 4区 材料科学 Q3 METALLURGY & METALLURGICAL ENGINEERING Pub Date : 2025-11-18 DOI: 10.1134/S2070205125700571
L. S. Tsybulskaya, S. S. Perevoznikov, V. S. Shendyukov, V. A. Kukareko, A. N. Grigorchik, A. V. Kushnerov, Lafargue Perez Francisco

The structure and properties of a nickel–boron coating with an immersion-deposited gold–cobalt film were studied. It has been shown that the application of a thin gold film (30–32 nm) protects the functional nickel–boron coating from oxidation during long-term storage under normal conditions and annealing for 1 h in an air atmosphere in the temperature range of 250–350°C. It has been established that, during annealing of the modified coating, no mutual diffusion of the elements of the substrate and coating occurs. X-ray structural analysis of the modified Ni–B coating showed that the diffraction patterns contain diffraction lines from gold, broadened lines from a solid solution of boron in nickel of the interstitial-substituted type. Low temperature annealing (250–300°C) the Ni–B coating modified with an Au–Co film leads to a decrease in the width of the diffraction lines of the matrix solid solution of boron in nickel, as well as to an increase in the values of its crystal lattice parameter and an increase in the microhardness of the coating to 850–890 HV 0.025. Annealing of the coating at 350°C leads to the release of nanosized particles of the nickel boride phase and is accompanied by a decrease in microhardness to 720–750 HV 0.025. It was concluded that the nickel–boron coating with a gold–cobalt protective film applied after annealing has increased microhardness (850–890 HV 0.025), high wear resistance under boundary friction conditions (linear wear intensity of the coating Ih = 1.6 × 1010 µm/m) and a low coefficient of friction (f = 0.15), which makes Ni–B/Au–Co coatings comparable in their tribotechnical characteristics to chromium coatings. Modified Ni–B/Au–Co coatings retain the ability to be soldered using low-temperature solder and non-active alcohol–rosin flux, and also have low contact electrical resistance after long-term storage.

研究了浸镀金-钴膜镍硼涂层的结构和性能。结果表明,在正常条件下长期储存和在250 ~ 350℃的空气气氛中退火1 h时,应用薄金膜(30 ~ 32 nm)可以保护功能镍硼涂层免受氧化。结果表明,在改性涂层退火过程中,基体元素与涂层元素不发生相互扩散。对改性Ni-B涂层的x射线结构分析表明,其衍射谱线包含来自金的衍射谱线,以及来自硼在镍中的溶解体的宽谱线。经Au-Co膜改性的Ni-B涂层在低温退火(250 ~ 300℃)后,基体硼在镍中的固溶体的衍射线宽度减小,其晶格参数值增大,镀层显微硬度提高到850 ~ 890 HV 0.025。涂层在350℃下退火导致纳米级硼化镍相颗粒的释放,显微硬度降低到720-750 HV 0.025。结果表明,镀有金钴保护膜的镍硼涂层具有显微硬度(850 ~ 890 HV 0.025)、边界摩擦条件下的高耐磨性(涂层线性磨损强度Ih = 1.6 × 1010 μ m/m)和低摩擦系数(f = 0.15),使Ni-B / Au-Co涂层的摩擦技术性能可与铬涂层相比较。改性Ni-B / Au-Co涂层保留了使用低温焊料和非活性醇松香助焊剂进行焊接的能力,并且在长期储存后也具有低接触电阻。
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引用次数: 0
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Protection of Metals and Physical Chemistry of Surfaces
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