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Journal of Quantitative Spectroscopy & Radiative Transfer最新文献

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Analysis of periodic temporal changes in the spectral signature of IR sources by modeling of spectral artifacts in FTIR systems 利用FTIR系统中光谱伪影的建模分析红外光源光谱特征的周期性时间变化
IF 2.3 3区 物理与天体物理 Q2 OPTICS Pub Date : 2024-12-17 DOI: 10.1016/j.jqsrt.2024.109320
David Santalices, Juan Meléndez, Susana Briz
Periodic fluctuations in the incoming spectrum to a Fourier-transform infrared (FTIR) spectrometer often result in spectral artifacts that can compromise quantitative measurements. This study presents a novel method that relaxes the conventional assumption of uniform fluctuations across all frequencies, by modeling the radiance fluctuations with a Fourier series expansion with wavenumber-dependent coefficients. By limiting the incoming spectral bandwidth with an interference filter, it is possible to retrieve the artifact-free average spectrum and to obtain the temporal evolution of the incident radiance. Experimental validation was conducted with transmittance measurements on a methane gas sample whose column density was periodically modulated. This method expands FTIR capabilities, particularly for applications involving fluctuating gases, and enhances the potential for time-resolved analysis in complex environments.
傅里叶变换红外(FTIR)光谱仪的入射光谱的周期性波动通常会导致光谱伪影,从而影响定量测量。本研究提出了一种新的方法,通过用波数相关系数的傅立叶级数展开来模拟辐射波动,从而放松了所有频率均匀波动的传统假设。通过用干涉滤光片限制入射光谱带宽,可以获得无伪影的平均光谱,并获得入射辐射的时间演变。通过周期性调节柱密度的甲烷气体样品的透光率测量进行了实验验证。该方法扩展了FTIR的功能,特别是在涉及波动气体的应用中,并增强了在复杂环境中进行时间分辨分析的潜力。
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引用次数: 0
Electron scattering from hydrogen atom in dense semi-classical hydrogen plasma: S-wave resonance states 致密半经典氢等离子体中氢原子的电子散射:s波共振态
IF 2.3 3区 物理与天体物理 Q2 OPTICS Pub Date : 2024-12-15 DOI: 10.1016/j.jqsrt.2024.109318
Netai Das, Arijit Ghoshal, Yew Kam Ho
The existence and the behaviour of the resonance states in the scattering of electrons from the hydrogen atoms under semi-classical plasma environments are investigated. The organized effect of the plasma charged particles is modelled by a pseudopotential which takes care of the quantum mechanical effect of diffraction at short distances as well as the collective effect of the plasma particles by means of two adjustable parameters, namely the de Broglie wavelength λ and the screening parameter κ. An extensive square-integrable basis set is employed within the framework of the stabilization method to determine the S-wave resonance states in the e-H system. In particular, the emergence of three S-wave singlet resonance states is identified by noting the stabilized energy levels, whereas the energy and the width of those states are computed from the fitting of the density of the states with the Lorentzian form. The results for the plasma-free case are in good agreement with the established results in the literature. A comprehensive study is made on the changes in the energy and width of the resonance states as a result of variation in λ at a given κ.
研究了半经典等离子体环境下氢原子电子散射共振态的存在及其行为。等离子体带电粒子的组织效应是用伪势来模拟的,伪势通过两个可调参数,即德布罗意波长λ和屏蔽参数κ来照顾短距离衍射的量子力学效应和等离子体粒子的集体效应。在稳定方法的框架内,采用了一个广泛的平方可积基集来确定e-H系统的s波共振状态。特别是,三个s波单重态共振状态的出现是通过注意稳定的能级来识别的,而这些状态的能量和宽度是通过状态密度与洛伦兹形式的拟合来计算的。无等离子体情况下的结果与文献中已建立的结果很好地一致。全面研究了共振态的能量和宽度的变化,这是由于λ在给定κ处的变化所导致的。
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引用次数: 0
Separated and cooperative influence of components of ice cloud on total extinction of optical radiation 冰云组分对光辐射总消光的分离与协同影响
IF 2.3 3区 物理与天体物理 Q2 OPTICS Pub Date : 2024-12-14 DOI: 10.1016/j.jqsrt.2024.109323
Olga Shefer
For set of crystals with and without taking into account nonsphericity and preferential orientation, there are presented the calculation results that generalize the features of the spectral behavior of the extinction efficiency factor of radiant energy. The influence of various physico-chemical characteristics of scatterers on extinction is demonstrated. The scheme is proposed for comparative analysis of the extinction coefficient of visible and infrared radiation for different components of ice cloud. Considering a medium containing methane and large ice plates, there is demonstrated the scheme to estimate cooperative and separated contributions of dispersed and gas components to the total extinction by the mixture.
对于考虑和不考虑非球性和优先取向的晶体,给出了概括了辐射能量消光效率因子光谱行为特征的计算结果。论证了散射体的各种物理化学特性对消光的影响。提出了冰云不同组分可见光和红外辐射消光系数的对比分析方案。考虑到含有甲烷和大冰板的介质,给出了估算分散组分和气体组分对混合物总消光的协同和分离贡献的方案。
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引用次数: 0
Comparison of atmospheric river-related phenomena with ACE satellite data 大气河流相关现象与ACE卫星数据的比较
IF 2.3 3区 物理与天体物理 Q2 OPTICS Pub Date : 2024-12-10 DOI: 10.1016/j.jqsrt.2024.109321
Adam Pastorek, Peter Bernath
We present a comprehensive data analysis of coincident solar occultation data captured by the ACE satellite, alongside the atmospheric river database derived from MERRA-2 reanalysis through the ARTMIP (Atmospheric River Tracking Method Intercomparison Project) initiative. Our investigation, comparing an atmospheric river catalogue by Guan and Waliser (2015) with experimental ACE data, reveals significant differences in altitude-dependent volume-mixing ratios (VMRs) of several molecules (particularly H2O, HNO3, and O3). These differences are observed in pairs of ACE observations that are closely matched in time and location, with one point falling within an identified atmospheric river and the other outside. Additionally, we demonstrate that these differences in VMR profiles are not attributable to random atmospheric turbulence. This is achieved by contrasting our findings with a randomized set of paired ACE observations, where both data points are situated outside of atmospheric rivers. The obtained results corroborate atmospheric mixing between the troposphere and stratosphere during the passage of an atmospheric river through a specific location. Our findings demonstrate the utility of ACE satellite data in observing atmospheric phenomena associated with atmospheric rivers.
我们对ACE卫星捕获的同步太阳掩星数据进行了全面的数据分析,并通过ARTMIP(大气河流跟踪方法比对项目)倡议对MERRA-2再分析得出的大气河流数据库进行了综合分析。我们的研究将Guan和Waliser(2015)的大气河流目录与实验ACE数据进行了比较,揭示了几种分子(特别是H2O、HNO3和O3)在海拔相关的体积混合比(VMRs)方面存在显著差异。这些差异是在时间和地点密切匹配的成对ACE观测中观察到的,一个点落在确定的大气河流内,另一个落在确定的大气河流外。此外,我们证明了VMR剖面的这些差异不能归因于随机大气湍流。这是通过将我们的发现与随机配对的ACE观测结果进行对比来实现的,其中两个数据点都位于大气河流之外。所得结果证实了在大气河流通过特定位置时对流层和平流层之间的大气混合。我们的发现证明了ACE卫星数据在观测与大气河流相关的大气现象方面的效用。
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引用次数: 0
Collision expansion for the radiative transport equation: Analytical results and numerical simulations 辐射输运方程的碰撞展开:分析结果和数值模拟
IF 2.3 3区 物理与天体物理 Q2 OPTICS Pub Date : 2024-12-10 DOI: 10.1016/j.jqsrt.2024.109311
Vadim A. Markel, Manabu Machida, John C. Schotland
We consider the collision expansion of the Green’s function of the radiative transport equation (RTE) in an infinite medium. Analytical expressions in terms of quadratures of the most simple form are given for all orders of the expansion. Singularities of the Green’s function are considered in detail. While it is well known that the zeroth and first terms in the expansion are singular (and proportional to delta functions), we show that the second order term contains a logarithmic singularity. All higher-order terms are regular. We further establish a relation between the Green’s function and the signal measured by a collimated detector. In the presence of singularities, this relation is not always obvious and, at second order, it cannot be stated in a form that is independent of the acceptance angle of the detector. We also consider the density and energy current. Theoretical results are supported by Monte-Carlo simulations.
我们考虑了辐射输运方程(RTE)的格林函数在无限介质中的碰撞展开。对于展开式的所有阶,给出了最简单形式的正交解析表达式。详细讨论了格林函数的奇异性。众所周知,展开式中的第0项和第1项是奇异的(并且与δ函数成正比),我们证明了第2项包含对数奇异性。所有高阶项都是正则的。我们进一步建立了格林函数与准直探测器测量信号之间的关系。在奇点存在的情况下,这种关系并不总是明显的,而且在二阶情况下,它不能以一种与检测器的接受角无关的形式来表述。我们还考虑了密度和能量电流。理论结果得到了蒙特卡罗模拟的支持。
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引用次数: 0
Atmospheric water vapor continuum model for the sub-THz range 亚太赫兹范围的大气水汽连续体模型
IF 2.3 3区 物理与天体物理 Q2 OPTICS Pub Date : 2024-12-09 DOI: 10.1016/j.jqsrt.2024.109319
M.Yu. Tretyakov, T.A. Galanina, A.O. Koroleva, D.S. Makarov, D.N. Chistikov, A.A. Finenko, A.A. Vigasin
Empirical and semi-empirical models of the continua absorption are still ubiquitously used in atmospheric science and applications despite almost a hundred-years-long persistent theoretical and experimental investigation of the continuum' nature. Based on the empirical knowledge accumulated to-date about the water vapor continuum we propose a physically sound continuum model for practical applications in the subterahertz frequency range (0-1 THz). Our model interpret the water vapor continuum in terms of a combination of various contributions owed to bimolecular absorption. The self-continuum component is presented in the model as a sum of the contributions from absorption by bound and quasibound dimers, which are evaluated with the help of the water vapor second virial coefficient and existing ab initio simulation of the water dimer absorption. The contribution from the far wings of the water monomer resonant lines is taken into account by virtue of a simple analytical function approximating available empirical data. The foreign-continuum component of absorption is taken in a conventional empirical form. The values of its numerical coefficients are updated to achieve better agreement with results of laboratory measurements in the sub-THz range. We demonstrate that our new model is in good agreement with modern versions of atmospheric propagation models. However, the atmospheric brightness temperature calculated using our new model systematically deviates from the results obtained with its empirical version. The deviation amounts up to several Kelvins in the microwindows between resonant water lines.
尽管对连续体的性质进行了近百年的理论和实验研究,但连续体吸收的经验和半经验模型仍然普遍应用于大气科学和应用中。基于迄今积累的关于水蒸气连续体的经验知识,我们提出了一个实际应用于亚太赫兹频率范围(0-1太赫兹)的物理声连续体模型。我们的模型根据双分子吸收的各种贡献的组合来解释水蒸气连续体。模型中的自连续统分量是由束缚型和准束缚型二聚体吸收贡献的总和,利用水蒸气第二维里系数和现有的水二聚体吸收从头算模拟来评估。水单体共振线远翼的贡献通过一个简单的近似经验数据的解析函数来考虑。吸收的外来连续统分量采用传统的经验形式。更新了其数值系数值,使其与亚太赫兹范围内的实验室测量结果更加吻合。我们证明,我们的新模式与现代版本的大气传播模式很好地吻合。然而,用我们的新模型计算的大气亮温与经验模型的结果有系统的偏差。在共振水线之间的微窗口中,偏差可达几个开尔文。
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引用次数: 0
GAAS: GPU accelerated absorption simulator GAAS: GPU 加速吸收模拟器
IF 2.3 3区 物理与天体物理 Q2 OPTICS Pub Date : 2024-12-07 DOI: 10.1016/j.jqsrt.2024.109307
Charles S. Callahan, Sean M. Bresler, Sean C. Coburn, David A. Long, Gregory B. Rieker
Interpreting measured absorption spectroscopy data can require repeated simulations of the expected absorption spectrum to fit the data. In cases of high temperature or broadband spectra, the computational load of the spectral analysis can be expensive due to the large number of individual absorption transitions that contribute to each simulation. We present a Graphics Processing Unit (GPU) Accelerated Absorption Simulator (GAAS) – a fast, hardware-accelerated, line-by-line absorption simulation software for generating absorption spectra based on Voigt and Hartmann-Tran lineshape profiles. We show that GAAS produces the same output spectra as the high-resolution transmission molecular absorption database (HITRAN) Application Programming Interface (HAPI) to within 32-bits of numerical precision for spectra based on both Voigt and Hartmann-Tran profiles. We also measure the performance increase compared to HAPI and demonstrate that GAAS can reduce simulation time by up to 115x for spectra containing many (several thousand or more) absorption transitions. The software is provided as an open-source python library which is built around an OpenCL implementation of the Voigt and Hartmann-Tran lineshape functions. GAAS can be run on a variety of GPU hardware including integrated GPUs on most computers and high-performance external GPUs. It is installed as a standalone Python library, making it accessible and easy to use for many applications. GAAS will enable researchers to more efficiently analyze complex spectra, especially using advanced lineshapes, to ultimately increase the accuracy of complex spectroscopic measurements.
解释测量的吸收光谱数据可能需要重复模拟预期的吸收光谱来拟合数据。在高温或宽带光谱的情况下,光谱分析的计算负荷可能是昂贵的,因为大量的单个吸收跃迁有助于每个模拟。我们提出了一个图形处理单元(GPU)加速吸收模拟器(GAAS) -一个快速,硬件加速,逐行吸收模拟软件,用于生成基于Voigt和Hartmann-Tran线形轮廓的吸收光谱。研究表明,GAAS产生的输出光谱与高分辨率透射分子吸收数据库(HITRAN)应用程序编程接口(HAPI)相同,基于Voigt和Hartmann-Tran谱图的光谱的数值精度在32位以内。与HAPI相比,我们还测量了性能的提高,并证明对于包含许多(数千或更多)吸收跃迁的光谱,GAAS可以将模拟时间减少多达115倍。该软件是作为一个开源python库提供的,它是围绕Voigt和Hartmann-Tran线形函数的OpenCL实现构建的。GAAS可以在各种GPU硬件上运行,包括大多数计算机上的集成GPU和高性能外部GPU。它作为一个独立的Python库安装,使其易于访问和使用许多应用程序。GAAS将使研究人员能够更有效地分析复杂光谱,特别是使用先进的线形状,最终提高复杂光谱测量的精度。
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引用次数: 0
Transmittance of Gaussian beams in biological tissues 生物组织中高斯光束的透射率
IF 2.3 3区 物理与天体物理 Q2 OPTICS Pub Date : 2024-12-06 DOI: 10.1016/j.jqsrt.2024.109312
Murat Kaan Özcan, Muhsin Caner Gökçe, Yahya Baykal
The study examines the average transmittance of Gaussian beams passing through various biological tissues, taking into account the impact of turbulence, absorption, and scattering. The extended Huygens-Fresnel technique, which utilizes the power spectrum of turbulent biological tissues, is applied to determine the optical intensity at the observation point. Additionally, there are tabulated absorption and scattering coefficients available for the application of the Beer-Lambert law, facilitating the calculation of optical light attenuation in biological tissues. Examining the impact of turbulence, as well as absorption and scattering-induced attenuation on the Gaussian beam's propagation, the changes in transmittance are documented across different tissue parameters.
研究考察了高斯光束穿过各种生物组织时的平均透射率,并考虑了湍流、吸收和散射的影响。扩展的惠更斯-菲涅尔技术利用湍流生物组织的功率谱来确定观测点的光强度。此外,在应用比尔-朗伯定律时,还提供了吸收和散射系数表,便于计算生物组织中的光衰减。通过研究湍流以及吸收和散射引起的衰减对高斯光束传播的影响,记录了不同组织参数下透射率的变化。
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引用次数: 0
Convolutional neural network for 2D-reconstructions of rough particles from their experimental speckle images in interferometric particle imaging 干涉粒子成像中粗糙粒子实验散斑图像的卷积神经网络二维重建
IF 2.3 3区 物理与天体物理 Q2 OPTICS Pub Date : 2024-12-06 DOI: 10.1016/j.jqsrt.2024.109315
Alexis Abad, Alexandre Poux, Marc Brunel
A convolutional neural network (CNN) has been trained to reconstruct the two-dimensional (2D) shape of rough particles from their interferometric defocused images. The experimental set-up uses a digital micro-mirror device (DMD). The particles programmed on the DMD can have different morphologies: stick, cross, dendrite, L, T and Y. Sticks, crosses and dendrites are centrosymmetric, while l-, T-, and Y-shaped particles are non-centrosymmetric. For each family of particle, the training of the CNN has been performed for particle's sizes that cover a decade from hundreds of micrometers to millimeters, and for an arbitrary 3D-orientation of the particle. Accurate reconstructions and particle sizing can be done. Using three orthogonal views of the same particle, a three-dimensional (3D) reconstruction can be further done to estimate the 3D-morphology of the particle.
卷积神经网络(CNN)已经被训练用来从干涉散焦图像中重建粗糙颗粒的二维(2D)形状。实验装置采用数字微镜装置(DMD)。在DMD上编程的颗粒可以具有不同的形态:棒状、十字形、枝晶、L形、T形和y形。棒状、十字形和枝晶是中心对称的,而L形、T形和y形颗粒是非中心对称的。对于每个家族的粒子,CNN的训练已经完成了从数百微米到毫米的粒子大小,以及粒子的任意3d方向的训练。可以进行精确的重建和粒度测定。利用同一粒子的三个正交视图,可以进一步进行三维重建,以估计粒子的三维形态。
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引用次数: 0
Inversion of optical constants of natural silk fibers based on FDTD-PSO and scattering experiments 基于 FDTD-PSO 和散射实验的天然丝纤维光学常数反演
IF 2.3 3区 物理与天体物理 Q2 OPTICS Pub Date : 2024-12-05 DOI: 10.1016/j.jqsrt.2024.109314
Zhengwei Tao, Jun Qiu
The optical constants of fiber materials are of great value in the study of the mechanism and application of radiation regulation, but the conventional methods for obtaining the optical constants of fiber materials suffer from a series of problems such as compositional differences, chemical residues, and microstructural damages, which make it difficult to obtain the optical constants of the fiber materials and make the final results of the measurements doubtful. In this work, a new intelligent inversion method is developed, based on the first-principles calculations of electromagnetic scattering using Finite Difference Time Domain method and particle swarm optimization algorithm (FDTD-PSO), to obtain the optical constants of fibers through the measurement of the scattered radiation properties of fiber materials and the characterization of their surface microstructures. The feasibility and accuracy of the method are demonstrated by theoretical numerical calculation simulations of different kinds of fibers, and the scale effect and error are analyzed from three aspects, namely, scale parameters, roughness and incident light angle direction. The results show that the dimensions, roughness and incident wavelength of the fiber material are in the sub-wavelength scale interval, which requires high model accuracy and gives the appropriate inversion range interval. Finally, the method is experimentally validated by using the natural silk fibers. This work constructs a complete set of theoretical models and experimental methods to accurately obtain the optical constants of actual fiber materials, which provides a new direction for obtaining the optical constants of fiber materials and a numerical basis for the study of the radiation modulation mechanism of fiber materials.
纤维材料的光学常数在辐射调控机理和应用研究中具有重要价值,但传统的纤维材料光学常数获取方法存在成分差异、化学残留、微结构损伤等一系列问题,导致纤维材料光学常数难以获得,最终测量结果存疑。本研究在利用有限差分时域法和粒子群优化算法(FDTD-PSO)进行电磁散射第一原理计算的基础上,开发了一种新的智能反演方法,通过测量纤维材料的散射辐射特性和表征其表面微结构来获得纤维的光学常数。通过对不同种类纤维的理论数值计算模拟,证明了该方法的可行性和准确性,并从尺度参数、粗糙度和入射光角方向三个方面分析了尺度效应和误差。结果表明,光纤材料的尺寸、粗糙度和入射波长均处于亚波长尺度区间,对模型精度要求较高,因此给出了合适的反演范围区间。最后,利用天然丝纤维对该方法进行了实验验证。这项工作构建了一套完整的理论模型和实验方法,可以精确地获得实际纤维材料的光学常数,为获得纤维材料的光学常数提供了新的方向,也为研究纤维材料的辐射调制机理提供了数值依据。
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引用次数: 0
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Journal of Quantitative Spectroscopy & Radiative Transfer
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