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Elastic Conductivity of Germanene Ribbons with Acceptor Defects 具有受体缺陷的日耳曼带的弹性传导性
IF 1.4 4区 化学 Q4 PHYSICS, ATOMIC, MOLECULAR & CHEMICAL Pub Date : 2024-07-22 DOI: 10.1134/s1990793124700015
O. S. Lebedeva, N. G. Lebedev, A. S. Chibrikov, E. N. Shamina

Abstract

This paper is a theoretical study of the piezoresistivity of germanene nanoribbons (GeNRs) of various structural modifications (arm-chair and zig-zag) with acceptor structural defects. Gallium atoms were chosen as impurities. A phenomenological expression for the band structure of nanoribbons (NRs) deformed by tension and compression is proposed. The dependencies of the longitudinal component of the elastic conductivity tensor on the relative deformation of tension and compression, the concentration of impurities, and the width of the NR are analyzed.

摘要 本文是对具有受体结构缺陷的各种结构修饰(扶手椅形和之字形)锗纳米带(GeNRs)的压阻系数进行的理论研究。镓原子被选为杂质。提出了纳米带(NRs)在拉伸和压缩变形时的带状结构现象学表达式。分析了弹性传导张量的纵向分量与拉伸和压缩的相对变形、杂质浓度和 NR 宽度的关系。
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引用次数: 0
Statistical Analysis of Flux Enhancements of Energetic Electrons in the Low-Latitudinal Ionosphere According to the Data from the NOAA/POES and MetOp Satellites from 1998 to 2022 根据 NOAA/POES 和 MetOp 卫星 1998 年至 2022 年的数据对低纬度电离层高能电子通量增强的统计分析
IF 1.4 4区 化学 Q4 PHYSICS, ATOMIC, MOLECULAR & CHEMICAL Pub Date : 2024-07-22 DOI: 10.1134/s1990793124700301
M. G. Golubkov, A. V. Suvorova, A. V. Dmitriev, G. V. Golubkov

Abstract

The intense precipitation of energetic electrons from the Earth’s radiation belt (ERB) is one of the most important sources of ionization in the ionosphere and atmosphere. A large-scale statistical analysis is carried out of the data from continuous low-orbit satellite observations of solar-cycle variations in the flux enhancements of the ERB electrons with energy >30 keV at an altitude of 850 km, acquired from the NOAA/POES and MetOp satellites in the interval from 1998 to 2022. The basic features of artificial failures in the satellite database with high-time resolution measurements in the interval from 2014 to 2022 are found and described. Appropriate data correction is carried out. It is shown that the average annual number of days with electron flux enhancements increases rapidly within three years after the solar-cycle maximum and reaches its greatest value near the middle of the declining phase of solar activity. Then the frequency of event occurrence begins to decrease noticeably within an 8-year interval, including the minimum, rising, and maximum phases of the solar cycle. The minimum level is achieved at the maximum solar activity.

摘要来自地球辐射带(ERB)的高能电子的强烈沉淀是电离层和大气层电离的最重要来源之一。对 NOAA/POES 和 MetOp 卫星在 1998 年至 2022 年期间获得的 850 公里高度处能量为 30 千伏安的 ERB 电子通量增强太阳周期连续低轨卫星观测数据进行了大规模统计分析。发现并描述了卫星数据库中 2014 年至 2022 年高时间分辨率测量数据人为故障的基本特征。进行了适当的数据校正。结果表明,电子通量增强的年平均天数在太阳周期最大值之后三年内迅速增加,并在太阳活动衰减阶段中期附近达到最大值。然后,在太阳活动周期的最小、上升和最大阶段的 8 年间隔内,事件发生的频率开始明显下降。在太阳活动最大时达到最小值。
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引用次数: 0
Low-Melting Hybrid Thermoplastics of Ammonium Polyphosphate 聚磷酸铵低熔点混合热塑性塑料
IF 1.4 4区 化学 Q4 PHYSICS, ATOMIC, MOLECULAR & CHEMICAL Pub Date : 2024-07-22 DOI: 10.1134/s1990793124700052
E. V. Stegno, V. Yu. Bychkov, N. A. Abramova, A. V. Grachev, V. M. Lalayan, A. Yu. Shaulov, A. A. Berlin

Abstract

In the interaction of high-molecular ammonium polyphosphate with polyethylene polyamine, thermoplastic polymers with Tg = 46.3–50.7°C, Tsoft = 43–92°C, and Tflow = 85–152°C are obtained. Thermal heat resistance, moisture resistance, and the degree of crystallinity depending on the concentration of polyethylene polyamine are measured. The bending strength of polymers and reinforced composites is measured. A chemical scheme for the formation of a polycomplex is proposed and its structure is considered.

摘要 在高分子聚磷酸铵与聚乙烯多胺的相互作用中,获得了 Tg = 46.3-50.7°C、Tsoft = 43-92°C、Tflow = 85-152°C 的热塑性聚合物。测量了耐热性、防潮性以及结晶度(取决于聚乙烯多胺的浓度)。测量了聚合物和增强复合材料的弯曲强度。提出了形成聚合体的化学方案,并对其结构进行了研究。
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引用次数: 0
Process of Magnetite Dissolution in Orthophosphoric and Sulfuric Acid Solutions According to Kinetic and Electrochemical Methods 根据动力学和电化学方法研究正磷酸和硫酸溶液中磁铁矿的溶解过程
IF 1.4 4区 化学 Q4 PHYSICS, ATOMIC, MOLECULAR & CHEMICAL Pub Date : 2024-07-22 DOI: 10.1134/s1990793124700106
A. V. Kuzin, A. V. Lobanov, V. A. Shelonzev, E. A. Eliseeva, A. S. Samadov

Abstract

The kinetics of dissolution and the electrochemical features of the behavior of magnetite (in cathodic polarization) in solutions of sulfuric and orthophosphoric acids are studied. Two independent experimental methods establish that the rate and current of dissolution in H3PO4 are higher than in H2SO4. This pattern is explained based on the stronger complexing properties of various kinds of phosphate anions in comparison with sulfate anions in solution with iron(III) ions. In the range of studied concentrations of orthophosphoric and sulfuric acids, as well as Fe(II) and Fe(III) ions, the reaction orders for orthophosphoric and sulfuric acids are 1.3 ± 0.1; for iron(II) ions, 0.25 ± 0.1; and for iron(III) ions, –0.25 ± 0.1.

摘要 研究了磁铁矿(阴极极化)在硫酸和正磷酸溶液中的溶解动力学和电化学特性。两种独立的实验方法确定了在 H3PO4 中的溶解速率和电流高于在 H2SO4 中的溶解速率和电流。这一规律的解释是,与硫酸根阴离子相比,各种磷酸盐阴离子在铁(III)离子的溶液中具有更强的络合特性。在所研究的正磷酸和硫酸以及铁(II)和铁(III)离子的浓度范围内,正磷酸和硫酸的反应顺序为 1.3 ± 0.1;铁(II)离子的反应顺序为 0.25 ± 0.1;铁(III)离子的反应顺序为 -0.25 ± 0.1。
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引用次数: 0
Photochemical and Antimicrobial Testing of TiO2 Nanoparticles Obtained by a Green Synthesis Method 用绿色合成法获得的 TiO2 纳米粒子的光化学和抗菌测试
IF 1.4 4区 化学 Q4 PHYSICS, ATOMIC, MOLECULAR & CHEMICAL Pub Date : 2024-07-22 DOI: 10.1134/s1990793124700143
V. M. Kumbhar, K. K. Kumar, T. K. Gade, K. D. Sonawane, S. Natarajan, S. A. Jadhav

Abstract

This work deals with phytochemical synthesis of TiO2 nanoparticles by using leaf extract of Ficus benghalensis tree and evaluation of their antibacterial and photocatalytic activities. The synthesized TiO2 nanoparticles were characterized by using X-ray diffraction, Attenuated total reflectance Infrared, UV visible spectroscopy and transmission electron microscopy as well as scanning electron microscopy techniques. The characterizations revealed formation of stable, spherical nanoparticles of anatase phase of TiO2 with average diameter of 21 nm. The particles showed excellent antibacterial activity against Bacillus cereus (Gram-positive) and Escherichia coli (Gram-negative) bacteria. The photocatalytic testing showed complete degradation of model pollutants from cationic and anionic dye family namely methylene blue (cationic dye) and methyl orange (anionic dye) that confirmed the excellent photocatalytic activity of the particles.

摘要 本研究利用榕树叶提取物进行植物化学合成 TiO2 纳米粒子,并对其抗菌和光催化活性进行了评估。利用 X 射线衍射、衰减全反射红外光谱、紫外可见光谱、透射电子显微镜和扫描电子显微镜技术对合成的 TiO2 纳米粒子进行了表征。表征结果表明,形成了稳定的锐钛矿相二氧化钛球形纳米粒子,平均直径为 21 纳米。这些颗粒对蜡样芽孢杆菌(革兰氏阳性)和大肠杆菌(革兰氏阴性)具有出色的抗菌活性。光催化测试表明,该颗粒可完全降解阳离子和阴离子染料家族的模型污染物,即亚甲基蓝(阳离子染料)和甲基橙(阴离子染料),这证实了该颗粒具有出色的光催化活性。
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引用次数: 0
Heterogeneous Reaction of Dimethyl Sulfide with a Chlorine Atom 二甲基硫醚与氯原子的异相反应
IF 1.4 4区 化学 Q4 PHYSICS, ATOMIC, MOLECULAR & CHEMICAL Pub Date : 2024-07-22 DOI: 10.1134/s1990793124700209
I. K. Larin, G. B. Pronchev, E. M. Trofimova

Abstract

The reaction rate constant of a chlorine atom with dimethyl sulfide (DMS) is measured in the temperature range 308–366 K by the method of resonant fluorescence (RF) of chlorine atoms. It is shown that the reaction rate constant decreases during experiments at a higher temperature. At a temperature of 308 K, the rate constant of this reaction is measured at different ratios of the reaction time and the diffusion time of chlorine atoms to the reactor wall. The data of these experiments show that with an increase in the diffusion time of the active centers to the surface of the reactor, compared with the contact time of the reagents, a decrease in the measured reaction rate constant is observed. This allows us to assert that the reaction is heterogeneous and the interaction of the chlorine atom with the DMS occurs on the surface of the reactor.

摘要 通过氯原子的共振荧光(RF)方法,测量了氯原子与二甲基硫醚(DMS)在 308-366 K 温度范围内的反应速率常数。实验表明,温度越高,反应速率常数越小。在 308 K 的温度下,按反应时间和氯原子向反应器壁扩散时间的不同比率测量了该反应的速率常数。这些实验数据表明,与试剂的接触时间相比,随着活性中心向反应器表面扩散的时间增加,测得的反应速率常数也随之降低。由此我们可以断定,反应是异质的,氯原子与二甲基亚砜的相互作用发生在反应器的表面。
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引用次数: 0
The Electronic and Optical Properties of Ultrathin Nanostructured Praseodymium Disulfide 超薄纳米结构二硫化镨的电子和光学特性
IF 1.4 4区 化学 Q4 PHYSICS, ATOMIC, MOLECULAR & CHEMICAL Pub Date : 2024-07-22 DOI: 10.1134/s1990793124700167
J. Zhang, W. Wang

Abstract

The lanthanide disulfides have been studied many times, but their various physical chemistry properties still need to be improved. In this paper, we carried out calculations based on density functional theory to investigate the structural, electronic, optical, and elastic properties for ultrathin nanostructured praseodymium disulfide. The band structures and density of states were calculations and analyses in the part of electronic property. We also calculated the real and imaginary parts of dielectric function, absorption coefficient, extinction coefficient and reflectivity to deeply analyze the optical properties. It’s found that praseodymium disulfide shows good characteristics required for potential photovoltaic applications. In addition, the elastic properties were evaluated to check mechanical stability and examine relevant elastic parameters such as Young’s modulus, shear modulus, Poisson’s ratio, etc. Our results indicate that praseodymium disulfide has attractive mechanical, electronic, and optical properties, which making this ultrathin nanostructure suitable for photovoltaic device and engineering applications.

摘要 二硫化镧已经被研究了很多次,但其各种物理化学性质仍有待提高。本文基于密度泛函理论对超薄纳米结构二硫化镨的结构、电子、光学和弹性性质进行了研究。在电子特性部分,我们计算并分析了带状结构和态密度。我们还计算了介电常数的实部和虚部、吸收系数、消光系数和反射率,对光学性质进行了深入分析。研究发现,二硫化镨具有良好的光电应用特性。此外,还对弹性特性进行了评估,以检查机械稳定性和相关弹性参数,如杨氏模量、剪切模量、泊松比等。我们的研究结果表明,二硫化镨具有诱人的机械、电子和光学特性,使这种超薄纳米结构适用于光伏设备和工程应用。
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引用次数: 0
Kinetics of Decomposition of 1,1-Diamino-2,2-Dinitroethylene (Fox-7): 5. Vapor Pressure and Reaction in the Gas Phase 1,1-Diamino-2,2-Dinitroethylene (Fox-7) 的分解动力学:5.气相中的蒸汽压和反应
IF 1.4 4区 化学 Q4 PHYSICS, ATOMIC, MOLECULAR & CHEMICAL Pub Date : 2024-07-22 DOI: 10.1134/s1990793124700118
G. M. Nazin, A. I. Kazakov, T. S. Larikova, A. V. Nabatova, N. N. Volkova

Abstract

The pressure of 1,1-diamino-2,2-dinitroethylene (FOX-7) vapors in the temperature range 140–160°C is determined by the manometric method. The correlation dependence of log Pvap on 1/T is established, which makes it possible to estimate the value of Pvap with satisfactory accuracy in the temperature range of 100–200°C. The kinetics of the reaction in the gas phase are measured at temperatures of 200–230°C and m/V = 10–3–10–4 g/cm3. It is found that under these conditions, in parallel with the usual monomolecular isomerization reaction into the aci-form, a chain process of the direct oxidation of FOX-7 by NO2 proceeds. The consequence of this reaction is a significant decrease in the activation energy observed and the appearance of a dependence of the rate on the experimental conditions. The scheme of the main stages of the chain reaction is presented and the conditions necessary for the manifestation of this reaction are determined.

摘要 采用压力计法测定了 140-160°C 温度范围内 1,1-二氨基-2,2-二硝基乙烯 (FOX-7) 蒸汽的压力。建立了对数 Pvap 与 1/T 的相关性,从而可以在 100-200°C 的温度范围内以令人满意的精度估算 Pvap 值。在温度为 200-230°C 和 m/V = 10-3-10-4 g/cm3 的条件下,测量了气相反应的动力学。研究发现,在这些条件下,在通常的单分子异构化反应转化为 Aci-form 的同时,FOX-7 被 NO2 直接氧化的链式过程也在进行。这一反应的结果是活化能显著降低,并出现了速率与实验条件相关的现象。本文介绍了链式反应主要阶段的方案,并确定了该反应发生的必要条件。
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引用次数: 0
Ignition of a Gasless Mixture Array by a Combustion Wave 用燃烧波点燃无气混合物阵列
IF 1.4 4区 化学 Q4 PHYSICS, ATOMIC, MOLECULAR & CHEMICAL Pub Date : 2024-07-22 DOI: 10.1134/s199079312470009x
A. P. Aldushin, P. M. Krishenik, S. A. Rogachev

Abstract

The methods of mathematical modeling are used to explore the initiation of combustion of a large mass of a condensed mixture in the local contact with the end face of the burning layer. It is shown that the minimum width of the igniting layer is proportional to the width of the thermal front of the combustion wave. The coefficient of proportionality is determined by the initial temperature, heat, and activation energy of the reaction. The calculation results can be used to estimate the effective activation energy of the reaction that controls the combustion mechanism of a gasless system.

摘要 采用数学建模方法探讨了大量冷凝混合物在与燃烧层端面局部接触处开始燃烧的过程。研究表明,着火层的最小宽度与燃烧波的热前沿宽度成正比。比例系数由反应的初始温度、热量和活化能决定。计算结果可用于估算控制无气系统燃烧机理的反应有效活化能。
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引用次数: 0
Colloidal-Graphite Suspension Based on Thermally Expanded Graphite 基于热膨胀石墨的胶体石墨悬浮液
IF 1.4 4区 化学 Q4 PHYSICS, ATOMIC, MOLECULAR & CHEMICAL Pub Date : 2024-07-22 DOI: 10.1134/s1990793124700027
V. N. Gorshenev

Abstract

Currently, modified oxidized (intercalated) graphites (OGs) and thermally expanded graphites (TEGs) obtained from them are used to solve many applied problems. This is due to the fact that while retaining all the properties of layered graphite compounds, split graphite particles have important new properties, such as ease of molding, low bulk density, and active interaction with the polymer matrix. However, the question of the mechanisms of expansion of OG and the properties of TEG particles split into layers has not been sufficiently studied. The establishment of experimental patterns of expansion processes of graphite oxidized by acids contributes to the understanding of the set of stages of complex processes occurring during the expansion of graphite particles in a gas atmosphere and in polymer matrices. The aim of this study is to synthesize a colloidal-graphite (CG) suspension based on TEG particles and determine the properties of suspensions and expansion processes of OG during thermal and microwave heating. As a result of modifying TEG with a low bulk density in the activating media, CG suspensions are synthesized without a vibration grinding stage. The splitting of graphite materials after chemical modification by thermal and microwave-stimulated heating leads to the formation of graphene-like structures. The development of techniques for modifying electrically conductive porous samples of materials used as electrodes makes it possible to introduce nanographite particles under the influence of an electric field.

摘要目前,改性氧化(插层)石墨(OGs)和由其制成的热膨胀石墨(TEGs)被用于解决许多应用问题。这是因为在保留层状石墨化合物所有特性的同时,裂解石墨颗粒具有重要的新特性,如易于成型、体积密度低以及与聚合物基体的相互作用活跃等。然而,关于 OG 的膨胀机制和分层 TEG 颗粒的特性问题还没有得到充分研究。建立酸氧化石墨膨胀过程的实验模式有助于了解石墨颗粒在气体环境和聚合物基质中膨胀时发生的一系列复杂过程。本研究的目的是以 TEG 颗粒为基础合成胶体石墨(CG)悬浮液,并确定悬浮液的性质以及热和微波加热过程中 OG 的膨胀过程。由于活化介质中的 TEG 体积密度较低,因此合成 CG 悬浮液无需振动研磨阶段。通过热和微波刺激加热对石墨材料进行化学改性后,石墨材料的分裂导致了类石墨烯结构的形成。对用作电极的材料的导电多孔样品进行改性的技术开发,使得在电场影响下引入纳米石墨颗粒成为可能。
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引用次数: 0
期刊
Russian Journal of Physical Chemistry B
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