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Structural and Electronic Properties in Monolayer MoS ({}_{mathbf{2}}) with Various Vacancies: First-Principles Calculations 具有各种空位的单层 MoS ({}_{mathbf{2}})的结构和电子特性:第一原理计算
IF 0.4 4区 物理与天体物理 Q4 PHYSICS, MULTIDISCIPLINARY Pub Date : 2024-10-09 DOI: 10.3103/S0027134924700668
Zhi-Xin Bai, Fan-Jin Lu, Qi-Jun Liu, Zheng-Tang Liu

The structural and electronic properties of perfect and defective MoS({}_{2}) have been calculated with first-principles density functional theory. The defect stability has been evaluated using the defect formation energy. The calculated results show that the formation of Mo, S, and Mo–S defects requires extra energy. Moreover, the S vacancy is energetically more favourable than the Mo vacancy. After doping, the defect level is introduced into the forbidden band. The defect level in the Mo defect model tends to be the acceptor level, while the defect level in the S defect model and Mo–S defect model tends to be the donor level. These three different defect models still maintain the direct band gap characteristics as perfect models. Then, the type of conduction after doping is also analyzed. The projected state density and the charge density of these four models have been analyzed, showing the positions of defect energy levels and change of chemical bonds.

利用第一原理密度泛函理论计算了完美和缺陷 MoS({}_{2}) 的结构和电子特性。利用缺陷形成能评估了缺陷的稳定性。计算结果表明,Mo、S 和 Mo-S 缺陷的形成需要额外的能量。此外,S 空位在能量上比 Mo 空位更有利。掺杂后,缺陷水平被引入禁带。Mo 缺陷模型中的缺陷水平趋向于受体水平,而 S 缺陷模型和 Mo-S 缺陷模型中的缺陷水平趋向于供体水平。这三种不同的缺陷模型仍然保持了完美模型的直接带隙特性。然后,还分析了掺杂后的传导类型。分析了这四种模型的投影态密度和电荷密度,显示了缺陷能级的位置和化学键的变化。
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引用次数: 0
Experimental Assessment of Magnetic Resonance Imaging Distortion for Radiation Therapy Planning 用于放射治疗规划的磁共振成像失真实验评估
IF 0.4 4区 物理与天体物理 Q4 PHYSICS, MULTIDISCIPLINARY Pub Date : 2024-10-09 DOI: 10.3103/S0027134924700632
E. N. Lykova, A. A. Shcherbakov, A. P. Strelkovskaya, F. R. Studenikin, S. A. Gavrilova, A. P. Chernyaev

MRI is widely used in radiation therapy planning, particularly in stereotactic radiosurgery for brain metastases. The article addresses the geometric distortion of MRI images, which can lead to errors in radiation therapy planning. A series of experiments with a simple phantom were conducted on two MRI scanners with 0.5 and 1.5 T magnetic fields. Deviations in the positions of the phantom objects from their actual locations were observed. The detected deviations can reach up to 5 mm. A theoretical dependence of the magnetic field gradient on the distance to the center of homogeneity was calculated, which agrees well with the approximation of experimental data. An assessment was made of the dependence of the image area distortion of objects located at the center of the field homogeneity on their actual sizes. It was found that the area deviation can reach up to 20(%).

核磁共振成像广泛应用于放射治疗计划,尤其是治疗脑转移瘤的立体定向放射外科手术。文章探讨了磁共振成像图像的几何失真,这种失真可能导致放射治疗计划的错误。在两台磁场分别为 0.5 和 1.5 T 的磁共振成像扫描仪上用一个简单的模型进行了一系列实验。实验中观察到模型物体的位置与实际位置存在偏差。检测到的偏差可达 5 毫米。计算出了磁场梯度对均匀性中心距离的理论依赖性,这与实验数据的近似值非常吻合。对位于磁场均匀性中心的物体的图像面积失真与实际大小的关系进行了评估。结果发现,面积偏差可达 20(%)。
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引用次数: 0
Orbital and Spin Parts of Angular Momentum Flux Density of Monochromatic Radiation in Nonabsorbing Media with Nonlocal Nonlinear Optical Response 具有非局部非线性光学响应的非吸收介质中单色辐射角动量通量密度的轨道和自旋部分
IF 0.4 4区 物理与天体物理 Q4 PHYSICS, MULTIDISCIPLINARY Pub Date : 2024-10-09 DOI: 10.3103/S0027134924700619
P. S. Ryzhikov, V. A. Makarov

Using the conservation law for the angular momentum of electromagnetic field in the form of a balance equation, which links the angular momentum density, the angular momentum flux density, and the torque density caused by the anisotropy of the medium in a nonabsorbing medium, formulas for the densities of the orbital and spin parts of the angular momentum and the flux densities of these quantities are derived in the case of the interaction of monochromatic waves in a nonabsorbing medium with spatial dispersion that demonstrates an (n)th order nonlinear optical response to an external light field. In media without spatial and frequency dispersion, the obtained expressions coincide with the canonical expressions for the densities of the orbital and spin parts of the angular momentum, as well as their flux densities. Related to the nonlinearity of the medium, additional terms to the greatest components of the spin parts of the angular momentum and its flux densities can reach ten percent of the corresponding linear parts during the self-focusing of an elliptically polarized Gaussian laser beam in an isotropic gyrotropic medium near the area of its collapse.

利用平衡方程形式的电磁场角动量守恒定律,将非吸收介质中的角动量密度、角动量通量密度和介质各向异性引起的转矩密度联系起来、在具有空间色散的非吸收介质中,单色波的相互作用对外部光场表现出(n)阶非线性光学响应时,角动量的轨道和自旋部分的密度以及这些量的通量密度的公式被推导出来。在没有空间和频率色散的介质中,所得到的表达式与角动量轨道和自旋部分的密度及其通量密度的经典表达式相吻合。与介质的非线性有关的是,当椭圆偏振高斯激光束在各向同性陀螺介质中靠近其坍缩区域进行自聚焦时,角动量自旋部分的最大分量及其通量密度的附加项可以达到相应线性部分的百分之十。
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引用次数: 0
Cross Section Evaluation for Exclusive Channels of (boldsymbol{K}^{boldsymbol{+}}boldsymbol{Lambda}) and (boldsymbol{K}^{boldsymbol{+}}boldsymbol{Sigma}^{boldsymbol{0}}) Electroproduction off Protons Using CLAS Detector Data 使用 CLAS 探測器數據對(oldsymbol{K}^{oldsymbol{+}}oldsymbol{Lambda})和(oldsymbol{K}^{oldsymbol{+}}oldsymbol{Sigma}^{oldsymbol{0}})質子電生產的獨占通道進行截面評估
IF 0.4 4区 物理与天体物理 Q4 PHYSICS, MULTIDISCIPLINARY Pub Date : 2024-10-09 DOI: 10.3103/S0027134924700577
A. V. Golda, A. A. Golubenko, M. M. Davydov, E. L. Isupov, V. I. Mokeev, S. A. Savkin, V. V. Chistyakova

In this work, a method for evaluating the cross sections of electroproduction of (K^{+}Lambda^{0}) and (K^{+}Sigma^{0}) off protons in the region of invariant masses of final hadrons (M_{K}+M_{Y}<W<2.65) GeV ((M_{K}) and (M_{Y}) being the masses of the kaon and hyperon, respectively) and squares of four-momentum transfers of virtual photons, i.e., photon virtualities (0<Q^{2}<5) GeV({}^{2}), is developed based on experimental data of these exclusive channels’ cross sections measured by the CLAS detector in Hall B at Jefferson Lab. A set of algorithms has been implemented to evaluate the differential cross sections of these channels, along with their statistical and systematic uncertainties. A program was developed for the evaluation of differential cross sections and structure functions using C++ and Python libraries. An interactive website was created for working with the program, enabling the analysis of one-dimensional and two-dimensional dependences of structure functions and differential cross sections. The evaluation of differential cross sections for the (K^{+}Lambda) and (K^{+}Sigma^{0}) electroproduction channels is necessary for extracting the structure function (sigma_{LT^{prime}}) from the data on the polarization asymmetry of electroproduction reactions of these final states with longitudinally polarized electrons. The obtained results are also important for the development of realistic Monte Carlo event generators in planning future experiments and for evaluating the efficiency of detecting final particles when extracting reaction cross sections from experimental data.

在这项工作中,有一种方法可以评估在最终强子的不变质量 (M_{K}+M_{Y}<W<2.65)GeV((M_{K})和(M_{Y})分别是kaon和hyperon的质量)和虚光子四动量转移的平方,即、光子虚拟性 (0<Q^{2}<5) GeV({}^{2}) 是根据杰斐逊实验室B大厅的CLAS探测器测量到的这些专属信道截面的实验数据开发的。我们采用了一套算法来评估这些信道的差分截面及其统计和系统不确定性。使用 C++ 和 Python 库开发了一个程序,用于评估微分截面和结构函数。为使用该程序创建了一个交互式网站,以便分析结构函数和微分截面的一维和二维依赖关系。为了从这些最终态与纵向极化电子的电生化反应的极化不对称数据中提取结构函数(sigma_{LT^{prime}}),必须对(K^{+}Lambda)和(K^{+}Sigma^{0})电生化通道的微分截面进行评估。获得的结果对于在规划未来实验时开发现实的蒙特卡洛事件发生器,以及在从实验数据中提取反应截面时评估探测最终粒子的效率也非常重要。
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引用次数: 0
Using Gamma Distribution to Obtain Maxwell–Rényi Statistics and Other Generalized Distributions 利用伽马分布获取麦克斯韦尔-雷尼统计和其他广义分布
IF 0.4 4区 物理与天体物理 Q4 PHYSICS, MULTIDISCIPLINARY Pub Date : 2024-10-09 DOI: 10.3103/S0027134924700589
D. V. Nakashidze, A. M. Savchenko, T. N. Bakiev

A universal method is proposed for performing calculations within the framework of generalized statistics generated by the parametric Tsallis, Rényi, and Sharma–Mittal entropies. The essence of the approach lies in the use of an auxiliary gamma distribution whose parameters correspond to a particular variant of the statistics. Equations are derived that allow the generalised partition function and the mean energy to be expressed in terms of canonical quantities. The effectiveness of the proposed method is demonstrated using the example of Rényi statistics. The Maxwell–Rényi distribution is obtained and its properties are calculated, based on which assumptions about the possible nature of the generalised parameter are formulated.

本文提出了一种通用方法,用于在参数化查利斯熵、雷尼熵和夏尔马-米塔尔熵生成的广义统计框架内进行计算。该方法的精髓在于使用辅助伽马分布,其参数与统计量的特定变体相对应。推导出的等式允许用规范量来表示广义分割函数和平均能量。以雷尼统计为例,证明了所提方法的有效性。我们获得了 Maxwell-Rényi 分布并计算了其属性,在此基础上提出了广义参数可能性质的假设。
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引用次数: 0
Using Entropy in Time Series Analysis 在时间序列分析中使用熵
IF 0.4 4区 物理与天体物理 Q4 PHYSICS, MULTIDISCIPLINARY Pub Date : 2024-10-09 DOI: 10.3103/S0027134924700607
A. M. Adelyanov, E. A. Generalov, Wen Zhen, L. V. Yakovenko

Results of experiments in the field of biophysics are often presented as time series obtained with low resolution and not always of great length. In particular, in studies of the effects of various physico-chemical factors on bilayer lipid membranes, transmembrane ion currents and their fluctuations are usually measured. In this case, the mean values and variances of the currents may not differ significantly, making it difficult to determine the nature and degree of impact based on them. Therefore, the development of approaches to time series analysis has never ceased. Attempts to use the entropy of random variable distributions in such analysis have been made for a long time, but in practical work, these approaches have been difficult to implement, especially due to the requirements for the length of the series and the absence of noise. In recent decades, there have been significant changes in this area, and many new methods of time series analysis using various modifications of entropy have been proposed. In this regard, there is a need for a summary of methods based on entropy calculation, indicating their advantages and disadvantages. This is the goal of the proposed brief review of entropy-based methods for analyzing scalar time series, which can be useful in analyzing experimental data. The review considers only some of the basic approaches on which further algorithmic improvements are based. The concept of entropy sometimes causes difficulties for students, so the review can also be useful for educational purposes.

生物物理学领域的实验结果通常以时间序列的形式呈现,分辨率较低,长度也不总是很长。特别是在研究各种物理化学因素对双层脂膜的影响时,通常会测量跨膜离子电流及其波动。在这种情况下,电流的平均值和方差可能差别不大,因此很难根据它们确定影响的性质和程度。因此,时间序列分析方法的发展从未停止过。利用随机变量分布的熵进行此类分析的尝试由来已久,但在实际工作中,这些方法很难实现,特别是由于对序列长度和无噪声的要求。近几十年来,这一领域发生了重大变化,提出了许多利用熵的各种修正进行时间序列分析的新方法。在这方面,有必要对基于熵计算的方法进行总结,指出其优缺点。这就是本文提出的简要评述基于熵的标量时间序列分析方法的目的,这些方法可用于分析实验数据。本综述只考虑了一些基本方法,并在此基础上对算法进行了进一步改进。熵的概念有时会给学生造成困难,因此本综述也可用于教育目的。
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引用次数: 0
Experimental Study and Quantitative Analysis of the Physical Parameters of the Proton Therapy Scanning Beam Delivery System 质子治疗扫描光束传输系统物理参数的实验研究和定量分析
IF 0.4 4区 物理与天体物理 Q4 PHYSICS, MULTIDISCIPLINARY Pub Date : 2024-10-09 DOI: 10.3103/S0027134924700644
V. A. Kiselev, A. P. Chernyaev, Yu. D. Udalov, M. A. Belikhin, A. M. Demidova, S. E. Gritsenko

The development of proton therapy techniques imposes strict requirements for the accuracy of proton beam delivery. Existing methods for determining the planning target volume allow one to take into account only the influence of patient positioning errors before the start of irradiation. In this paper, the results of work on taking into account proton therapy system beam delivery errors for determining the planning target volume are presented. The technique for measuring the proton beam parameters and analyzing the measurement results is described. The calculation of the minimum required margin from the clinical target volume is carried out to guarantee its irradiation, taking into account the errors in beam delivery by the proton therapy system.

质子治疗技术的发展对质子束输送的准确性提出了严格要求。现有的规划目标体积确定方法只能考虑照射开始前病人定位误差的影响。本文介绍了在确定规划靶体积时考虑质子治疗系统束流传输误差的工作成果。本文介绍了测量质子束参数和分析测量结果的技术。考虑到质子治疗系统的射束传输误差,计算了临床靶体积的最小所需余量,以保证靶体积的辐照。
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引用次数: 0
Temperature Changes in Luminescence of Mixed Complexes of Terbium and Samarium with Organic Ligands Based on 2,2({}^{boldsymbol{prime}})-bipyridylcarboxamides 基于 2,2({}^{boldsymbolprime}})-联吡啶羧酰胺的铽钐与有机配体混合络合物发光的温度变化
IF 0.4 4区 物理与天体物理 Q4 PHYSICS, MULTIDISCIPLINARY Pub Date : 2024-10-09 DOI: 10.3103/S0027134924700620
A. V. Kharcheva, K. D. Shmelkov, Yu. G. Sokolovskaya, A. V. Ivanov, N. E. Borisova, S. V. Patsaeva

Solutions in acetonitrile of three mixed complexes of rare-earth elements (terbium and samarium) with organic ligands with various pyridine substituents were studied in this work. The ratios of ligands and metals in the resulting complexes were determined, and the stability constants of samarium complexes were calculated using the spectrophotometric titration method. Measurements of absorption-, emission-, and excitation spectra of luminescence, luminescence kinetics of solutions of mixed complexes of rare-earth elements with an excess of metal relative to the ligand were carried out at various temperatures in the range 298–328 K. For the first time, an increase of luminescence intensity of a samarium ion in complex upon heating was observed. The dependences of the luminescence quantum yield and lifetime of mixed complexes on temperature were obtained. A thermometric parameter—the ratio of the integral luminescence intensities of samarium and terbium ions—was proposed, and the temperature sensitivity coefficient of this parameter was determined for different complexes.

这项工作研究了稀土元素(铽和钐)与具有不同吡啶取代基的有机配体在乙腈中的三种混合络合物溶液。测定了所得络合物中配体和金属的比例,并使用分光光度滴定法计算了钐络合物的稳定常数。在 298-328 K 范围内的不同温度下,对金属相对于配体过量的稀土元素混合络合物溶液的发光吸收、发射和激发光谱以及发光动力学进行了测量。研究还获得了混合络合物的发光量子产率和寿命与温度的关系。提出了一个测温参数--钐离子和铽离子的积分发光强度之比,并确定了该参数对不同复合物的温度敏感系数。
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引用次数: 0
Vacuum Polarization in the Point Impurity Background 点杂质背景下的真空极化
IF 0.4 4区 物理与天体物理 Q4 PHYSICS, MULTIDISCIPLINARY Pub Date : 2024-10-09 DOI: 10.3103/S0027134924700541
Yu. V. Grats, P. A. Spirin

The vacuum polarization effect of a massive scalar field (phi(x)) near the point (delta)-like source is considered. The corresponding interaction is introduced within a technique of self-adjoint extension of the Laplace operator. This method has been widely discussed within the framework of quantum mechanics. We propose to use it to investigate vacuum field effects. This approach allows computing the renormalized Hadamard function and the renormalized vacuum energy density (langle T_{00}(x)rangle_{textrm{ren}}) for massive real scalar field with minimal curvature coupling. The dependence of the vacuum polarization effect upon the fields’s mass is analyzed.

我们考虑了一个大质量标量场(phi(x))在类似于点(delta)的源附近的真空极化效应。在拉普拉斯算子的自联合扩展技术中引入了相应的相互作用。这种方法已在量子力学框架内得到广泛讨论。我们建议用它来研究真空场效应。这种方法可以计算具有最小曲率耦合的大质量实标量场的重正化哈达玛函数和重正化真空能量密度(langle T_{00}(x)rangle_textrm{ren}} )。分析了真空极化效应对场质量的依赖性。
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引用次数: 0
Suppression of the Effect of Parametric Instability in the LIGO Voyager Gravitational Wave Detector 抑制 LIGO 旅行者引力波探测器中的参数不稳定性效应
IF 0.4 4区 物理与天体物理 Q4 PHYSICS, MULTIDISCIPLINARY Pub Date : 2024-10-09 DOI: 10.3103/S0027134924700553
S. E. Strigin

The number of unstable combinations of elastic and Stokes optical modes of the LIGO Voyager gravitational wave detector, frequencies and spatial distributions of displacement vectors of elastic modes of the mirrors were calculated. The values of overlap factors for unstable modes up to ninth-order optical modes were calculated, taking into account the azimuthal condition of parametric instability. An analysis of the influence of the temperature dependence of the Young’s modulus of the mirror material on the number of unstable modes in the Fabry–Perot cavity was performed.

计算了 LIGO 旅行者引力波探测器的弹性光学模式和斯托克斯光学模式的不稳定组合数量、频率以及反射镜弹性模式位移矢量的空间分布。考虑到参数不稳定性的方位角条件,计算了九阶以下不稳定模式的重叠因子值。还分析了镜面材料的杨氏模量随温度变化对法布里-珀罗腔中不稳定模式数量的影响。
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引用次数: 0
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Moscow University Physics Bulletin
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