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Dependence of Plasma Maser Emission Spectra on Azimuthal Plasma Concentration Inhomogeneity 等离子体激光器发射光谱与等离子体方位角浓度不均匀性的关系
IF 1.1 4区 物理与天体物理 Q3 PHYSICS, MULTIDISCIPLINARY Pub Date : 2024-08-29 DOI: 10.3103/S1541308X24700250
A. E. Donets, V. I. Rogozhin, V. P. Bakhtin, A. B. Buleyko, A. G. Bykov, O. T. Loza, A. A. Ravaev

Probe measurements of plasma generated by the thermionic cathode of the axially symmetric plasma maser are performed. Emission spectra of this plasma maser are recorded in its operation mode of a noise amplifier in the frequency band from 3 to 16 GHz at the power level of ~50 MW. It is shown that violation of azimuthal plasma concentration homogeneity leads to broadening of the emission spectrum by 30 to 100% of the central frequency. A possibility is found for pulse-to-pulse electron control of the width of the plasma maser emission spectrum in addition to the electron control of the frequency.

摘要 对轴对称等离子体激光器的热电阴极产生的等离子体进行了探针测量。该等离子体 maser 的发射光谱是在噪声放大器的工作模式下以 ~50 MW 的功率在 3 至 16 GHz 频段内记录的。结果表明,等离子体浓度方位角均匀性的破坏会导致发射光谱变宽,达到中心频率的 30%至 100%。除了电子控制频率之外,还发现了脉冲到脉冲电子控制等离子体激光唱片发射光谱宽度的可能性。
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引用次数: 0
Effect of Laser-Induced Heating of the Antiferromagnetic IrMn Layer on Generation of Terahertz Pulses in Co/WSe2-Based Spintronic Emitters 激光诱导加热反铁磁性 IrMn 层对 Co/WSe2 自旋电子发射器产生太赫兹脉冲的影响
IF 1.1 4区 物理与天体物理 Q3 PHYSICS, MULTIDISCIPLINARY Pub Date : 2024-08-29 DOI: 10.3103/S1541308X24700262
A. V. Gorbatova, A. M. Buryakov, P. Yu. Avdeev, E. D. Lebedeva, I. Yu. Pashen’kin, E. A. Karashtin, M. V. Sapozhnikov, E. D. Mishina

Properties of spintronic terahertz generators based on the IrMn/Co/WSe2 and Co/WSe2 structures grown on sapphire substrates are investigated. It is demonstrated that the optical energy of the pump pulse plays a critical role in coercivity control and in generation of terahertz radiation by a structure with an antiferromagnetic IrMn layer. Analysis of terahertz loops of magnetic hysteresis obtained for pump energies ranging from 0.35 to 3.85 mJ/cm2 has shown that laser-induced heating of IrMn up to temperatures above the blocking temperature is accompanied by an increase in spin injection from the Co layer into IrMn layer and a consequent increase in THz emission efficiency. The results show importance of further investigation of thermal laser-induced processes in antiferromagnetic-based spintronic emitters in the vicinity of critical temperatures, which is of great significance of further development of terahertz spintronic and photonic devices based on antiferromagnetic materials.

摘要 研究了基于蓝宝石衬底上生长的 IrMn/Co/WSe2 和 Co/WSe2 结构的自旋电子太赫兹发生器的特性。结果表明,泵浦脉冲的光能在矫顽力控制和带有反铁磁性 IrMn 层的结构产生太赫兹辐射方面起着关键作用。对在 0.35 至 3.85 mJ/cm2 泵能量范围内获得的磁滞太赫兹环路的分析表明,激光诱导的 IrMn 加热温度高于阻断温度时,Co 层向 IrMn 层的自旋注入增加,太赫兹辐射效率随之提高。研究结果表明,进一步研究临界温度附近反铁磁性自旋电子发射器中的热激光诱导过程非常重要,这对进一步开发基于反铁磁性材料的太赫兹自旋电子和光子器件意义重大。
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引用次数: 0
Effect of the Contribution of the Local and Nonlocal Optical Response of an Isotropic Gyrotropic Medium on the Components of the Minkowski Energy–Momentum Tensor of the Electromagnetic Field of the Self-Focusing Beam 各向同性陀螺仪介质的局部和非局部光学响应对自聚焦光束电磁场闵科夫斯基能量-动量张量成分的影响
IF 1.1 4区 物理与天体物理 Q3 PHYSICS, MULTIDISCIPLINARY Pub Date : 2024-07-08 DOI: 10.3103/S1541308X24700201
P. S. Ryzhikov, V. A. Makarov

Contributions of the terms related to the local and nonlocal nonlinear optical responses of a medium are determined in the expressions for the energy density, energy flux density, momentum density, and momentum flux density of the electromagnetic field at the self-focusing of elliptically polarized light in a nonabsorbing isotropic gyrotropic medium. It is shown that the contributions of the nonlinear optical response of the medium to the above quantities are maximal at the spatial points where during self-focusing of narrow elliptically polarized beams, radiation becomes linearly polarized, and they may be as large as one tenth of the contributions to the components of the Minkowski energy–momentum tensor of the electromagnetic field that are related to the linear local optical response of the medium to the external light field. Nonlocality of the optical response increases the components of the Minkowski energy–momentum tensor of the electromagnetic field in some regions of the space and decreases them in the rest of them due to the sign reversal of the degree of the self-focusing beam ellipticity.

摘要 确定了介质的局部和非局部非线性光学响应相关项在非吸收各向同性陀螺介质中椭圆偏振光自聚焦时电磁场的能量密度、能量通量密度、动量密度和动量通量密度表达式中的贡献。研究表明,介质的非线性光学响应对上述量的贡献,在窄椭圆偏振光束自聚焦过程中辐射变为线性偏振的空间点是最大的,它们可能达到电磁场闵科夫斯基能动量张量分量贡献的十分之一,而这些分量与介质对外部光场的线性局部光学响应有关。由于自聚焦光束椭圆度的符号反转,光学响应的非局部性会增加空间某些区域的电磁场闵科夫斯基能动量张量的分量,而减少其余区域的分量。
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引用次数: 0
Optical Study of the Influence of the Medium Acidity on the Interaction between Gold Nanoparticles and Bovine Serum Albumin in Aqueous Solution 介质酸度对水溶液中金纳米粒子和牛血清白蛋白相互作用影响的光学研究
IF 1.1 4区 物理与天体物理 Q3 PHYSICS, MULTIDISCIPLINARY Pub Date : 2024-07-08 DOI: 10.3103/S1541308X24700213
E. A. Molkova, V. I. Pustovoi, I. V. Baimler, A. V. Simakin, D. E. Burmistrov, I. V. Gorudko, S. V. Gudkov

The influence of the solution acidity on the interaction between bovine serum albumin (BSA) molecules and gold nanoparticles in solutions has been investigated by absorbance spectroscopy, fluorescence spectroscopy, and dynamic light scattering (DLS). The influence of pH on the processes of aggregation–disaggregation of gold nanoparticles with BSA and without it and on the denaturation of protein solution is demonstrated. It is also shown that BSA molecules can stabilize gold nanoparticles at acidic pH values of 2.0–4.0. The data obtained can be useful for physiologists studying the influence of nanoparticles on different biological media of the body.

摘要 通过吸光度光谱法、荧光光谱法和动态光散射法(DLS)研究了溶液酸度对溶液中牛血清白蛋白(BSA)分子和金纳米粒子之间相互作用的影响。结果表明,pH 值对有 BSA 和无 BSA 的金纳米粒子的聚集-解聚过程以及蛋白质溶液的变性都有影响。研究还表明,在 pH 值为 2.0-4.0 的酸性环境中,BSA 分子可以稳定金纳米粒子。获得的数据对生理学家研究纳米粒子对人体不同生物介质的影响很有帮助。
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引用次数: 0
Structural Mechanisms of Transitions between Ices with Different Densities—Features of Water Phase Diagrams 不同密度冰之间转变的结构机理--水相图的特征
IF 1.1 4区 物理与天体物理 Q3 PHYSICS, MULTIDISCIPLINARY Pub Date : 2024-07-08 DOI: 10.3103/S1541308X24700183
E. A. Zheligovskaya, G. A. Lyakhov

Structural mechanisms are developed for transitions between ices with either high or low density. Fractions of hydrogen bonds retained in the course of the transitions are calculated. Relative degrees of space filling by molecules of the considered ices are estimated. An assumption is formulated and partially substantiated that boundary exists between ice phases in the low-temperature region of the PvT phase diagram of ices. A new method for construction of PvTb diagrams of water is justified using the results of the structural analysis. The hydrogen bond concentration b serves as the second order parameter of phase transitions.

摘要 为高密度或低密度冰之间的转变建立了结构机制。计算了过渡过程中保留的氢键比例。估算了所考虑的冰分子填充空间的相对程度。在冰的 PvT 相图的低温区域,冰相之间存在边界,这一假设已经提出并得到部分证实。利用结构分析结果证明了构建水 PvTb 相图的新方法。氢键浓度 b 是相变的二阶参数。
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引用次数: 0
Modeling of Self-Assembly of Water Nanostructures 水纳米结构的自组装建模
IF 1.1 4区 物理与天体物理 Q3 PHYSICS, MULTIDISCIPLINARY Pub Date : 2024-07-08 DOI: 10.3103/S1541308X24700158
M. V. Kirov

A specific feature of regular water nanostructures, as well as extended ice, is residual entropy. The number of configurations with different arrangement of hydrogen atoms (protons) is immense. Of prime interest are the most stable proton configurations. The properties of the most unfavorable configurations of water clusters and other ice-like systems are generally beyond the attention of researchers. In this paper we present the results of studying the most weakly bound proton configurations of water nanostructures. The highly unusual spontaneous structural transformations of some weakly bound configurations are enumerated. Rather unexpectedly, one of these transformations demonstrated a pronounced ability of cubic water clusters to self-organization. The results of studying the processes of self-organization of water nanostructures from these clusters are presented. Similar behavior of the simplest system of cubic water clusters and very complex biopolymers is indicated; this similarity covers the high-level self-organization, specific type of molecular asymmetry, self-assembly of one-dimensional aperiodic crystals, and the letter code.

摘要 常规水纳米结构以及扩展冰的一个具体特征是残余熵。氢原子(质子)不同排列的构型数量巨大。最令人感兴趣的是最稳定的质子构型。水簇和其他类冰系统中最不利构型的特性通常不在研究人员的关注范围之内。在本文中,我们介绍了对水纳米结构中最弱结合质子构型的研究结果。文中列举了一些弱结合构型极不寻常的自发结构转变。出乎意料的是,其中一种转变显示了立方水簇明显的自组织能力。本文介绍了研究这些水簇的纳米水结构自组织过程的结果。最简单的立方水簇系统与非常复杂的生物聚合物的行为相似;这种相似性包括高层次的自组织、特定类型的分子不对称、一维非周期性晶体的自组装以及字母代码。
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引用次数: 0
Natural Submicron Heterogeneities in Aqueous Solutions of ATP ATP 水溶液中的天然亚微米异质性
IF 1.1 4区 物理与天体物理 Q3 PHYSICS, MULTIDISCIPLINARY Pub Date : 2024-07-08 DOI: 10.3103/S1541308X24700134
N. V. Penkov, N. A. Penkova, V. A. Zhmurin, A. G. Pogorelov

Submicron heterogeneities (SMHs) spontaneously arising in aqueous solutions of adenosine triphosphate (ATP) are studied. Their size of about 100 nm is close to the size of SMHs earlier detected in other solutions. The SMHs have a ζ-potential of about –10 mV. It is one of their stability factors. It is shown that the tendency for ATP to form SMHs depends on the ionic composition. After removal of SMHs from the ATP solution by filtering they do not form for more than two hours in the presence of Ca2+, while when Ca2+ is absent or replaced with Mg2+, the SMHs form in less than 30 min. In some cases, fast formation of SMHs hampers their adequate investigation. Analysis of dielectric spectra of ATP solutions in the presence of Ca2+ before and after filering has shown that hydration of Ca·ATP complexes inside SMHs is manifested by lower binding of water molecules and smaller number of free water molecules as compared to hydration of Ca·ATP complexes not included in SMHs.

摘要 研究了三磷酸腺苷(ATP)水溶液中自发产生的亚微米异构体(SMHs)。它们的尺寸约为 100 nm,与早先在其他溶液中检测到的 SMHs 尺寸接近。SMHs的ζ电位约为-10 mV。这是它们的稳定因素之一。研究表明,ATP 形成 SMHs 的趋势取决于离子成分。通过过滤将 SMHs 从 ATP 溶液中去除后,在 Ca2+ 存在的情况下,SMHs 在两小时内不会形成,而当 Ca2+ 不存在或被 Mg2+ 取代时,SMHs 在不到 30 分钟内就会形成。在某些情况下,SMH 的快速形成阻碍了对它们的充分研究。对有 Ca2+ 存在的 ATP 溶液过滤前后的介电光谱分析表明,与不包含在 SMHs 中的 Ca-ATP 复合物的水合作用相比,SMHs 内 Ca-ATP 复合物的水合作用表现为水分子结合力较低,自由水分子数量较少。
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引用次数: 0
Generation of Reactive Oxygen Species during Water Drops Fall on a Solid Surface 水滴落在固体表面过程中活性氧的生成
IF 1.1 4区 物理与天体物理 Q3 PHYSICS, MULTIDISCIPLINARY Pub Date : 2024-07-08 DOI: 10.3103/S1541308X24700146
I. V. Baimler, S. V. Gudkov, T. A. Matveeva, A. V. Simakin, I. A. Shcherbakov

The concentration of hydrogen peroxide and hydroxyl radicals in dependence of the intensity (strength) of water drop impact on a solid surface has been measured. The intensity was varied by changing the fall height from 1 to 4 m and the tilt angle of the surface onto which drops fell. It is shown that the content of hydrogen peroxide and hydroxyl radicals in solution increases after the drop impact on the solid surface. Apparently, the main mechanism of the observed effects is the generation of singlet oxygen and its further reduction.

摘要 测量了过氧化氢和羟基自由基的浓度与水滴撞击固体表面的强度(力度)的关系。水滴落下的高度从 1 米到 4 米不等,水滴落下表面的倾斜角度也随之变化。结果表明,水滴撞击固体表面后,溶液中过氧化氢和羟基自由基的含量会增加。显然,观察到的效应的主要机制是单线态氧的产生及其进一步还原。
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引用次数: 0
Comparison of COSMO Water Models in Quantum Quasi-Docking 量子准对接中的 COSMO 水模型比较
IF 1.1 4区 物理与天体物理 Q3 PHYSICS, MULTIDISCIPLINARY Pub Date : 2024-07-08 DOI: 10.3103/S1541308X2470016X
D. C. Kutov, A. V. Sulimov, V. B. Sulimov

Two solvent models, COSMO (old parametrization) and COSMO2 (new parametrization) are compared for a set of protein–ligand complexes in quantum quasi-docking, which is two-stage docking: positioning of a ligand in a target protein and calculation of binding enthalpy of the protein–ligand system using the PM7 quantum-chemical semiempirical method. In quantum quasi-docking, a wide spectrum of unique low-energy minima of the protein–ligand system is first found while employing the classical force field. Then energies of all these minima are recalculated within one of the continual models using the modern PM7 method with allowance for the solvent, and the global energy minimum is determined among the recalculated energies. The solution of the quantum quasi-docking problem is the position of the ligand in the protein corresponding to the global minimum of the protein–ligand system energy calculated by the quantum-chemical method with allowance for the solvent. Effectiveness of quantum quasi-docking is defined by the value (below 2 Å) of the root-mean-square deviation of ligand atoms from one another in two positions, namely, the position of the ligand in the protein corresponding to the calculated global energy minimum and the experimentally found crystallized position of the ligand with the protein. Comparison is performed for ten protein–ligand test complexes with well-defined structures taken from the Protein Data Bank, for which the ligand–protein binding enthalpy is measured and the positioning of the ligand in the protein is successful in quasi-docking within both solvent models used. In both methods, PM7 + COSMO and PM7 + COSMO2, a high correlation coefficient of the experimental and calculated ligand–protein binding enthalpy is obtained for both calculation techniques. Allowance for moveability of protein atoms in calculations of binding enthalpy leads to an increase in its negative values and to a slight decrease in the correlation coefficient of the experimental and calculated values. The role of hydrogen bonds between protein and ligand atoms is revealed: their contribution to binding enthalpy ranges from 14 to 24% for different complexes. The results indicate the way of implementing quantum docking so that the global minimum of the protein–ligand system energy calculated by the quantum-chemical technique is immediately obtained using the global optimization procedure.

摘要 在量子准对接中比较了COSMO(旧参数化)和COSMO2(新参数化)两种溶剂模型对一组蛋白质-配体复合物的影响。在量子准对接过程中,首先要利用经典力场找到蛋白质配体系统独特的低能量极小值。然后,使用现代 PM7 方法在一个连续模型中重新计算所有这些最小值的能量,并考虑溶剂因素,在重新计算的能量中确定全局能量最小值。量子准对接问题的解就是配体在蛋白质中的位置,该位置与量子化学方法计算出的蛋白质-配体系统能量的全局最小值相对应,并考虑了溶剂因素。量子准对接的有效性由配体原子在两个位置上的均方根偏差值(低于 2 Å)来定义,这两个位置分别是配体在蛋白质中与计算出的全局能量最小值相对应的位置,以及实验发现的配体与蛋白质的结晶位置。对蛋白质数据库中十个结构明确的蛋白质配体测试复合物进行了比较,测量了配体与蛋白质的结合焓,配体在蛋白质中的位置在所用的两种溶剂模型中都成功地进行了准对接。在 PM7 + COSMO 和 PM7 + COSMO2 两种方法中,两种计算技术的配体-蛋白质结合焓的实验值和计算值的相关系数都很高。如果在计算结合焓时考虑到蛋白质原子的可移动性,结合焓的负值会增加,实验值和计算值的相关系数会略有下降。蛋白质原子和配体原子之间氢键的作用得到了揭示:在不同的复合物中,氢键对结合焓的贡献从 14% 到 24% 不等。研究结果表明了量子对接的实施方法,即通过量子化学技术计算出的蛋白质-配体系统能量的全局最小值可以通过全局优化程序立即得到。
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引用次数: 0
Method for Analysis of Asymmetric Spectra Based on the Information Entropy Model 基于信息熵模型的不对称光谱分析方法
IF 1.1 4区 物理与天体物理 Q3 PHYSICS, MULTIDISCIPLINARY Pub Date : 2024-07-08 DOI: 10.3103/S1541308X24700171
V. I. Kuzmin, A. A. Paramonov, D. L. Tytik, O. V. Souvorova

The possibility is considered of using asymmetric distributions to analyze emission/absorption spectra, which enables revealing the structure of polymodal spectra. A necessary condition for existence of the spectrum is a nonnegative relative increment of tis amplitude (emission/absorption intensity). The use of asymmetric distributions in spectrum shape simulation involves a certain type of differential equation, where the left-hand side is a relative amplitude increment and the right-hand side is the decreasing nonlinear function. As a result, a model is obtained, in which the signal amplitude increment is defined by classical results of statistical physics (L. Boltzmann, M Planck) and information theory (C. Shannon) that correspond to the limited growth model (Gompertz model). On the basis of the anamorphism of this model, relaxation parameters of the spectrum are determined, which are treated as objective characteristics of emission/absorption spectra. The result is illustrated by the analysis of the luminescence spectrum of deionized water.

摘要 考虑了使用非对称分布来分析发射/吸收光谱的可能性,这有助于揭示多模态光谱的结构。光谱存在的一个必要条件是其振幅(发射/吸收光谱强度)的非负相对增量。在光谱形状模拟中使用非对称分布涉及某种微分方程,其中左手边是相对振幅增量,右手边是递减非线性函数。这样就得到了一个模型,其中信号振幅增量由统计物理学(L. Boltzmann、M. Planck)和信息论(C. Shannon)的经典结果定义,与有限增长模型(Gompertz 模型)相对应。在该模型的变形基础上,确定了光谱的弛豫参数,这些参数被视为发射/吸收光谱的客观特征。对去离子水发光光谱的分析说明了这一结果。
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引用次数: 0
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Physics of Wave Phenomena
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