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Design and Application of a Liquid Detection Device Based on Transmission Near-Infrared Spectroscopic Imaging 基于透射近红外光谱成像的液体检测装置的设计与应用
IF 2 4区 化学 Q4 BIOCHEMICAL RESEARCH METHODS Pub Date : 2024-06-01 DOI: 10.1155/2024/8925458
Jintao Liu, Li Luo, Xiangyang Yu, Yefan Cai, Weibin Hong
Spectral imaging is performed primarily using reflective devices, but for transparent objects, especially transparent liquids, a transmission-based device is required to obtain more effective spectral imaging data. For this purpose, a transmitted spectral imaging data acquisition device based on a miniature multispectral spectrometer was developed and demonstrated its capability in the analysis of transparent liquids. This device allows rapid and noncontact acquisition of spectral imaging signals from transparent liquid samples. The design of the device mainly includes two parts: a shooting system and a master computer, and the optical path is optimized by selecting the appropriate diffusion plate. As an application example, a concentration-absorbance model of liquid samples at characteristic wavelengths was established and used to predict the concentrations of different liquid samples. Experimental results showed that the relative error of the predicted concentration values was within 4%, indicating excellent detection performance. Therefore, the design of the device demonstrates favorable feasibility and wide applicability in liquid detection systems.
光谱成像主要是通过反射装置进行的,但对于透明物体,尤其是透明液体,则需要透射装置来获取更有效的光谱成像数据。为此,我们开发了一种基于微型多光谱光谱仪的透射光谱成像数据采集设备,并在分析透明液体时展示了其能力。该装置可快速、非接触式地采集透明液体样品的光谱成像信号。该设备的设计主要包括两部分:拍摄系统和主控计算机,并通过选择合适的扩散板优化了光路。以应用为例,建立了液体样品在特征波长下的浓度-吸光率模型,并用于预测不同液体样品的浓度。实验结果表明,预测浓度值的相对误差在 4% 以内,显示了出色的检测性能。因此,该装置的设计在液体检测系统中具有良好的可行性和广泛的适用性。
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引用次数: 0
Feature Variable Selection Based on VIS-NIR Spectra and Soil Moisture Content Prediction Model Construction 基于 VIS-NIR 光谱和土壤含水量预测模型构建的特征变量选择
IF 2 4区 化学 Q4 BIOCHEMICAL RESEARCH METHODS Pub Date : 2024-05-18 DOI: 10.1155/2024/8180765
Nan Zhou, Jin Hong, Bo Song, Shichao Wu, Yichen Wei, Tao Wang
The hydrological cycle, surface energy balance, and the management of water resources are all significantly impacted by soil moisture. Because it governs the physical processes of evapotranspiration and rainfall penetration, surface soil moisture is a significant climatic variable. In this work, visible-near infrared (VIS-NIR) bands were used to compare and analyze the spectra of loess samples with varying moisture concentrations. The investigation looked at how changes in the soil moisture content impacted the response of the soil spectra. The researchers used a genetic algorithm (GA), interval combination optimization (ICO), and competitive adaptive reweighted sampling (CARS) to filter feature variables from full-band spectral data. To forecast the moisture content of loess on the soil surface, models like partial least squares regression (PLSR), support vector machine (SVM), and random forest (RF) were created. The findings indicate that: (1) the most reliable spectrum preprocessing technique is the first derivative (FD), which can significantly enhance the model’s prediction power and spectral characteristic information. (2) The feature band selection method’s prediction effect of soil moisture content is typically superior to that of full-spectrum data. (3) The random forest (RF) prediction model for soil moisture content with the highest accuracy was built by combining the genetic algorithm (GA) with the FD preprocessed spectra. The results may provide a new understanding on how to use VIS-NIR to measure soil moisture content.
土壤水分对水文循环、地表能量平衡和水资源管理都有重大影响。由于表层土壤水分控制着蒸散和降雨渗透的物理过程,因此它是一个重要的气候变量。在这项工作中,使用可见光-近红外(VIS-NIR)波段来比较和分析不同水分浓度的黄土样本的光谱。调查研究了土壤水分含量的变化如何影响土壤光谱的响应。研究人员使用遗传算法 (GA)、区间组合优化 (ICO) 和竞争性自适应加权采样 (CARS) 从全波段光谱数据中过滤特征变量。为了预测土壤表面黄土的含水量,研究人员创建了偏最小二乘回归(PLSR)、支持向量机(SVM)和随机森林(RF)等模型。研究结果表明(1) 最可靠的频谱预处理技术是一阶导数(FD),它能显著增强模型的预测能力和频谱特征信息。(2)特征波段选择法对土壤含水量的预测效果通常优于全谱数据。(3)将遗传算法(GA)与 FD 预处理光谱相结合,建立了准确度最高的土壤含水率随机森林(RF)预测模型。这些结果可为如何利用 VIS-NIR 测量土壤含水量提供新的认识。
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引用次数: 0
Soybean Saponin Content Detection Based on Spectral and Image Information Combination 基于光谱和图像信息组合的大豆皂素含量检测
IF 2 4区 化学 Q4 BIOCHEMICAL RESEARCH METHODS Pub Date : 2024-05-10 DOI: 10.1155/2024/7599132
Hongmin Sun, Xifan Meng, Yingpeng Han, Xiao Li, Xiaoming Li, Yongguang Li
Soybean saponin is a natural antioxidant and is anti-inflammatory. Hyperspectral analysis technology was applied to detect soybean saponin content rapidly and nondestructively in this paper. Firstly, spectral preprocessing methods were studied, and standard normal variable (SNV) was used to remove noise information. Secondly, a two-step hybrid variable selection approach based on synergy interval partial least squares (SiPLS) and iteratively retains informative variables (IRIV) was proposed to extract characteristic variables. Then, the ensemble learning model was constructed by back propagation neural network (BPNN), deep forest (DF), partial least squares regression (PLSR), and extreme gradient boosting (EXG). Finally, image information was combined into spectral data to improve model accuracy. The prediction coefficient of determination () of the final model reached 0.9216. It can provide rapid, nondestructive, and accurate detection technology of soybean saponin content. A combination of spectral and image information will provide a new idea for application of hyperspectral.
大豆皂素是一种天然抗氧化剂,具有消炎作用。本文应用高光谱分析技术快速、无损地检测大豆皂苷的含量。首先,研究了光谱预处理方法,采用标准正态变量(SNV)去除噪声信息。其次,提出了基于协同区间偏最小二乘法(SiPLS)和迭代保留信息变量(IRIV)的两步混合变量选择方法,以提取特征变量。然后,通过反向传播神经网络(BPNN)、深度森林(DF)、偏最小二乘回归(PLSR)和极梯度提升(EXG)构建了集合学习模型。最后,将图像信息与光谱数据相结合,以提高模型的准确性。最终模型的预测决定系数()达到 0.9216。它可以提供快速、无损、准确的大豆皂苷含量检测技术。光谱信息与图像信息的结合将为高光谱的应用提供新的思路。
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引用次数: 0
Nano-Scale Secondary Ion Mass Spectrometry: A Paradigm Shift in Soil Science 纳米级二次离子质谱仪:土壤科学的范式转变
IF 2 4区 化学 Q4 BIOCHEMICAL RESEARCH METHODS Pub Date : 2024-04-30 DOI: 10.1155/2024/3625623
Yasir Hanif Mir, Anzhen Qin, Shakeel Mir, Shafeeq Ur Rahman, Mehnaza Mushtaq, Mumtaz A. Ganie, M. H. Chesti, Javid A. Bhat, Zahoor A. Baba, M. Auyoub Bhat, Inayat M. Khan, Rehana Rasool, Aanisa Manzoor Shah, Shazia Sadiq, Syed Mohammed Basheeruddin Asdaq, Mohammad Javed Ansari, Ghulam Yasin
Soils exhibit structural heterogeneity across diverse spatio-temporal scales, yielding myriad of microhabitats, highlighting the need for a nuanced understanding of the intricate interactions within the soil matrix. At the nanometer scale, the interplay among organic matter (OM), mineral particles, and microbiota intricately govern the long-term destiny of soil carbon (C), nutrient cycling, and the fate of both organic and inorganic pollutants. Notably, the sorption of soil organic matter (SOM) onto smaller clay particles and its entrapment in microaggregates further contribute to this complex dynamic. Understanding these processes depends on recognizing their scale-dependent nature, necessitating sophisticated techniques for investigation. Although various methods are employed across scales, the current set of techniques still lacks the requisite sensitivity and resolution for microscale data collection. To address this limitation, the adoption of novel microscopic and spectroscopic techniques capable of probing molecular, isotopic, and elemental patterns at the micro to nano scale becomes imperative. Among these cutting-edge methodologies, the nano-scale secondary ion mass spectrometer (NanoSIMS) emerges as a paradigm-shifting tool. Representing the latest evolution in ion microprobes, NanoSIMS seamlessly integrates high-resolution microscopy and isotopic analysis, maintaining unparalleled signal transmission and spatial resolution, reaching as fine as 50 nm. Its capabilities extend beyond conventional applications in science, as evidenced by recent breakthroughs in utilizing NanoSIMS to study biophysical interfaces in soils. This article underscores the pressing need to advance the incorporation of NanoSIMS as a pioneering instrumentation technique in soil studies. Furthering the implementation of this novel instrumentation technique in soil studies will pave avenues and aid in the advancement of future research.
土壤在不同的时空尺度上呈现出结构异质性,产生了无数的微生境,这突出表明需要对土壤基质内错综复杂的相互作用有细致入微的了解。在纳米尺度上,有机物(OM)、矿物颗粒和微生物群之间的相互作用错综复杂地影响着土壤碳(C)的长期命运、养分循环以及有机和无机污染物的归宿。值得注意的是,土壤有机物质(SOM)在较小粘土颗粒上的吸附及其在微团聚体中的截留进一步促进了这种复杂的动态变化。要了解这些过程,就必须认识到它们的尺度依赖性,这就需要采用复杂的技术进行研究。尽管在不同尺度上采用了各种方法,但目前的技术仍然缺乏微尺度数据收集所需的灵敏度和分辨率。为了解决这一局限性,采用能够在微米到纳米尺度上探测分子、同位素和元素模式的新型显微镜和光谱技术势在必行。在这些前沿方法中,纳米尺度二次离子质谱仪(NanoSIMS)是一种改变范式的工具。作为离子微探针的最新发展,NanoSIMS 无缝集成了高分辨率显微镜和同位素分析,保持了无与伦比的信号传输和空间分辨率,最细可达 50 纳米。它的功能超出了传统的科学应用范围,最近在利用 NanoSIMS 研究土壤中的生物物理界面方面取得的突破就证明了这一点。这篇文章强调了将 NanoSIMS 作为土壤研究先锋仪器技术的迫切需要。在土壤研究中进一步应用这种新型仪器技术将为未来研究的发展铺平道路并提供帮助。
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引用次数: 0
Rapid Quality Assessment of Polygoni Multiflori Radix Based on Near-Infrared Spectroscopy 基于近红外光谱的何首乌快速质量评估
IF 2 4区 化学 Q4 BIOCHEMICAL RESEARCH METHODS Pub Date : 2024-03-20 DOI: 10.1155/2024/2477754
Bin Jia, Ziying Mai, Chaoqun Xiang, Qiwen Chen, Min Cheng, Longkai Zhang, Xue Xiao
The precise and prompt determination of quality control indicators such as moisture, stilbene glycosides, and anthraquinone glycosides is crucial in assessing the quality of Polygoni Multiflori Radix. Near-infrared spectroscopy is a nondestructive analytical technique that offers a more desirable approach than traditional methods for assessing content levels. In this study, various spectral preprocessing techniques were used to preprocess the raw spectral data. The spectral data were correlated with the determination of three-component contents using the partial least squares regression (PLSR) method. Then different algorithms, such as competitive adaptive weighted sampling (CARS), Monte Carlo uninformative variable elimination (MCUVE), and random frog hopping (RF), were used for model simplification and feature selection. The data suggest that the first-order deconvolution derivative (1st Dev.) processing of the spectral data is superior to other methods in all three model evaluation metrics. The PLSR model for moisture, stilbene glycosides, and anthraquinone glycosides produced the calibration coefficient of determination (R2C) of 0.82, 0.52, and 0.58, the root mean square error of cross validation (RMSECV) of 0.91%, 0.77%, and 0.69%, the prediction coefficient of determination (R2P) of 0.72, 0.28, and 0.54, the root mean square error of prediction (RMSEP) of 0.65%, 0.81%, and 0.75%, and relative percentage differences (RPDs) of 1.7, 1.0, and 0.8. After optimizing the model using CARS, R2C increased by 0.15%, 0.41%, and 0.34%, RMSECV decreased by 0.53%, 0.32%, and 0.24%, R2P increased by 0.21%, 0.63%, and 0.35%, RMSEP decreased by 0.36%, 0.41%, and 0.31%, and RPD increased by 1.1, 0.9, and 0.6, significantly improving the predictive capacity of the model. This research provides a feasible method for rapid compliance testing of Polygoni Multiflori Radix. To further improve the model’s performance and applicability, it is necessary to continuously expand the sample set with different varieties and locations for wide variation.
准确、及时地测定水分、链烯苷和蒽醌苷等质量控制指标,对于评估何首乌的质量至关重要。近红外光谱是一种无损分析技术,与传统方法相比,它在评估含量水平方面提供了一种更理想的方法。在这项研究中,使用了各种光谱预处理技术对原始光谱数据进行预处理。使用偏最小二乘回归(PLSR)方法将光谱数据与三组分含量的测定相关联。然后使用竞争性自适应加权采样(CARS)、蒙特卡罗无信息变量消除(MCUVE)和随机蛙跳(RF)等不同算法进行模型简化和特征选择。数据表明,在所有三个模型评估指标上,对光谱数据进行一阶解卷积导数(1st Dev.)处理的方法都优于其他方法。水分、链烯苷和蒽醌苷的 PLSR 模型的校准判定系数(R2C)分别为 0.82、0.52 和 0.58,交叉验证的均方根误差(RMSECV)分别为 0.91%、0.预测决定系数 (R2P) 为 0.72、0.28 和 0.54,预测均方根误差 (RMSEP) 为 0.65%、0.81% 和 0.75%,相对百分比差异 (RPD) 为 1.7、1.0 和 0.8。使用 CARS 对模型进行优化后,R2C 增加了 0.15%、0.41% 和 0.34%,RMSECV 减少了 0.53%、0.32% 和 0.24%,R2P 增加了 0.21%、0.63% 和 0.35%,RMSEP 减少了 0.36%、0.41% 和 0.31%,RPD 增加了 1.1、0.9 和 0.6,显著提高了模型的预测能力。该研究为快速检测何首乌的顺应性提供了一种可行的方法。为了进一步提高模型的性能和适用性,有必要不断扩大样本集,增加不同品种和地点的样本,以实现广泛的差异。
{"title":"Rapid Quality Assessment of Polygoni Multiflori Radix Based on Near-Infrared Spectroscopy","authors":"Bin Jia, Ziying Mai, Chaoqun Xiang, Qiwen Chen, Min Cheng, Longkai Zhang, Xue Xiao","doi":"10.1155/2024/2477754","DOIUrl":"https://doi.org/10.1155/2024/2477754","url":null,"abstract":"The precise and prompt determination of quality control indicators such as moisture, stilbene glycosides, and anthraquinone glycosides is crucial in assessing the quality of <i>Polygoni Multiflori</i> Radix. Near-infrared spectroscopy is a nondestructive analytical technique that offers a more desirable approach than traditional methods for assessing content levels. In this study, various spectral preprocessing techniques were used to preprocess the raw spectral data. The spectral data were correlated with the determination of three-component contents using the partial least squares regression (PLSR) method. Then different algorithms, such as competitive adaptive weighted sampling (CARS), Monte Carlo uninformative variable elimination (MCUVE), and random frog hopping (RF), were used for model simplification and feature selection. The data suggest that the first-order deconvolution derivative (1<sup>st</sup> Dev.) processing of the spectral data is superior to other methods in all three model evaluation metrics. The PLSR model for moisture, stilbene glycosides, and anthraquinone glycosides produced the calibration coefficient of determination (<i>R</i><sup>2</sup><sub><i>C</i></sub>) of 0.82, 0.52, and 0.58, the root mean square error of cross validation (RMSE<sub>CV</sub>) of 0.91%, 0.77%, and 0.69%, the prediction coefficient of determination (<i>R</i><sup>2</sup><sub><i>P</i></sub>) of 0.72, 0.28, and 0.54, the root mean square error of prediction (RMSE<sub><i>P</i></sub>) of 0.65%, 0.81%, and 0.75%, and relative percentage differences (RPDs) of 1.7, 1.0, and 0.8. After optimizing the model using CARS, <i>R</i><sup>2</sup><sub><i>C</i></sub> increased by 0.15%, 0.41%, and 0.34%, RMSE<sub><i>CV</i></sub> decreased by 0.53%, 0.32%, and 0.24%, <i>R</i><sup>2</sup><sub><i>P</i></sub> increased by 0.21%, 0.63%, and 0.35%, RMSE<sub><i>P</i></sub> decreased by 0.36%, 0.41%, and 0.31%, and RPD increased by 1.1, 0.9, and 0.6, significantly improving the predictive capacity of the model. This research provides a feasible method for rapid compliance testing of <i>Polygoni Multiflori</i> Radix. To further improve the model’s performance and applicability, it is necessary to continuously expand the sample set with different varieties and locations for wide variation.","PeriodicalId":17079,"journal":{"name":"Journal of Spectroscopy","volume":"30 1","pages":""},"PeriodicalIF":2.0,"publicationDate":"2024-03-20","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"140172007","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Raman Spectra of PbTe- and GeTe-Based Monocrystalline Epitaxial Layers 基于铅碲和锗碲的单晶外延层的拉曼光谱
IF 2 4区 化学 Q4 BIOCHEMICAL RESEARCH METHODS Pub Date : 2024-03-11 DOI: 10.1155/2024/5524783
N. Romcevic, B. Hadzic, P. Dziawa, T. Story, W. D. Dobrowolski, M. Romcevic
Lead telluride and germanium telluride are well-known IV-VI semiconductors, which is now the focus of research due to the perspective of application as thermoelectrics for midrange temperatures. Solid solutions and heterostructures on this basis, obtained by molecular beam epitaxy, are a promising direction for the development of these materials. In this paper, we have focused on the Raman spectra excited by the 514.5 nm laser line (out of resonance) of PbTe, GeTe, (Pb, Ge)Te, and (Pb, Ge, Eu)Te layers grown on BaF2 (111) monocrystalline substrates. The obtained phonon properties are related to the properties of the corresponding bulk materials or can be explained by a model that takes into account the difference in the masses of the constituent elements only, as is the case with the local mode of Ge in PbTe (registered at about 181 cm−1). Multiphonon processes registered for this phonon are a consequence of the change in the electronic structure of PbTe and electron-phonon interaction. An improvement in the quality of thin films due to doping with Eu ions was also registered.
碲化镉铅和碲化锗是著名的 IV-VI 半导体,由于可用作中温热电半导体,目前已成为研究的重点。在此基础上,通过分子束外延获得的固溶体和异质结构是这些材料的一个很有前途的发展方向。本文重点研究了生长在 BaF2 (111) 单晶基底上的 PbTe、GeTe、(Pb, Ge)Te 和 (Pb, Ge, Eu)Te 层在 514.5 nm 激光线(共振外)激发下的拉曼光谱。所获得的声子特性与相应块体材料的特性相关,或者可以用仅考虑组成元素质量差异的模型来解释,如 PbTe 中 Ge 的局部模式(约 181 cm-1)。该声子的多声子过程是碲化镉电子结构变化和电子-声子相互作用的结果。由于掺入了 Eu 离子,薄膜的质量也得到了改善。
{"title":"Raman Spectra of PbTe- and GeTe-Based Monocrystalline Epitaxial Layers","authors":"N. Romcevic, B. Hadzic, P. Dziawa, T. Story, W. D. Dobrowolski, M. Romcevic","doi":"10.1155/2024/5524783","DOIUrl":"https://doi.org/10.1155/2024/5524783","url":null,"abstract":"Lead telluride and germanium telluride are well-known IV-VI semiconductors, which is now the focus of research due to the perspective of application as thermoelectrics for midrange temperatures. Solid solutions and heterostructures on this basis, obtained by molecular beam epitaxy, are a promising direction for the development of these materials. In this paper, we have focused on the Raman spectra excited by the 514.5 nm laser line (out of resonance) of PbTe, GeTe, (Pb, Ge)Te, and (Pb, Ge, Eu)Te layers grown on BaF<sub>2</sub> (111) monocrystalline substrates. The obtained phonon properties are related to the properties of the corresponding bulk materials or can be explained by a model that takes into account the difference in the masses of the constituent elements only, as is the case with the local mode of Ge in PbTe (registered at about 181 cm<sup>−1</sup>). Multiphonon processes registered for this phonon are a consequence of the change in the electronic structure of PbTe and electron-phonon interaction. An improvement in the quality of thin films due to doping with Eu ions was also registered.","PeriodicalId":17079,"journal":{"name":"Journal of Spectroscopy","volume":"115 1","pages":""},"PeriodicalIF":2.0,"publicationDate":"2024-03-11","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"140106251","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Gemological and Spectral Characteristics of Gem-Quality Blue Gahnite from Nigeria 尼日利亚宝石级蓝榴莲石的宝石学和光谱特征
IF 2 4区 化学 Q4 BIOCHEMICAL RESEARCH METHODS Pub Date : 2024-02-10 DOI: 10.1155/2024/6693346
Yifang Chen, Junhao Zheng, Mingmei Lu, Ziqi Liu, Zhengyu Zhou
Gem-quality blue octahedral crystalline gahnite was produced in Nigeria. This paper investigated gemological and spectroscopic characteristics by basic gemological experiments, electron probes, infrared reflectance spectroscopy, laser Raman spectroscopy, photoluminescence spectroscopy, and ultraviolet-visible spectroscopy. The results show that the refractive index (RI) of Nigerian gahnite is 1.792∼1.794, and the specific gravity is 4.45∼4.66, with no fluorescence. The main chemical composition is ZnAl2O4, accounting for 93.57%, and the rest is mainly FeAl2O4, which also contains Na, Mg, Co, Mn, Cr, Cu, Si, K, and Ca elements. The infrared spectra showed midinfrared absorption bands near 510 cm−1, 559 cm−1, and 664 cm−1 in the fingerprint region, corresponding to the Zn-O stretching vibration, bending vibration, and Al-O bending vibration, respectively. The Raman spectra showed three of the five Raman active modes of the spinel group, with characteristic Raman absorption peaks located at 418 cm−1, 508 cm−1, and 660 cm−1, corresponding to Eg, T2g(2), and T2g(3) modes, respectively, and the comparison revealed a higher degree of Zn and Al ordering in this paper for gahnite. The photoluminescence spectra show the common Cr3+-activated fluorescence splitting peaks of natural spinel, of which the 686 nm (R-line) fluorescence peak is obvious and sharp. The UV-vis absorption spectra located at 444 nm and 489 nm are the most obvious, which are caused by the d-d electron leap of TFe2+ (5E ⟶ 5T2), and the blue-gray tones of the samples are mainly caused by the spin-forbidden electronic transitions in TFe2+ and MFe2+ ↔ MFe3+; the weak absorption peak at 609 nm was determined to be associated with Co2+ by derivative spectra.
尼日利亚出产宝石级蓝色八面体结晶芒硝。本文通过基本宝石学实验、电子探针、红外反射光谱、激光拉曼光谱、光致发光光谱和紫外-可见光谱研究了宝石学和光谱学特征。结果表明,尼日利亚芒硝的折射率(RI)为 1.792∼1.794,比重为 4.45∼4.66,无荧光。主要化学成分为 ZnAl2O4,占 93.57%,其余主要为 FeAl2O4,还含有 Na、Mg、Co、Mn、Cr、Cu、Si、K 和 Ca 等元素。红外光谱显示了指纹区 510 cm-1、559 cm-1 和 664 cm-1 附近的中红外吸收带,分别对应于 Zn-O 伸展振动、弯曲振动和 Al-O 弯曲振动。拉曼光谱显示了尖晶石基团五种拉曼活性模式中的三种,特征拉曼吸收峰位于 418 cm-1、508 cm-1 和 660 cm-1,分别对应 Eg、T2g(2) 和 T2g(3) 模式,比较发现本文中的芒硝具有更高的 Zn 和 Al 有序化程度。光致发光光谱显示出天然尖晶石常见的Cr3+激活荧光劈裂峰,其中686 nm(R线)荧光峰明显而尖锐。位于 444 nm 和 489 nm 处的紫外-可见吸收光谱最为明显,是由 TFe2+ 的 d-d 电子跃迁(5E ⟶ 5T2)引起的,样品的蓝灰色调主要是由 TFe2+ 和 MFe2+ ↔ MFe3+ 中的自旋禁用电子跃迁引起的;609 nm 处的微弱吸收峰通过衍射光谱确定与 Co2+ 有关。
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引用次数: 0
Application of Common Components Analysis to Mid-Infrared Spectra for the Authentication of Lebanese Honey 在中红外光谱中应用共同成分分析法鉴定黎巴嫩蜂蜜的真伪
IF 2 4区 化学 Q4 BIOCHEMICAL RESEARCH METHODS Pub Date : 2024-02-06 DOI: 10.1155/2024/3370665
Rita El Hajj, Wadih Skaff, Nathalie Estephan
Honey is considered as a premium food produced by honeybees. It is highly appreciated by consumers around the world and raises a major concern nowadays which is ensuring its authenticity in respect to its production and its botanical origin. In Lebanon, honey is mainly multifloral which makes its authentication rather difficult. While mid-infrared (MIR) spectroscopy combined with multivariate analysis has proven to be successful in authenticating unifloral honey, the challenge with Lebanese honey lies in assessing its performance with multifloral honey. Therefore, this work aims to test the performance of common components analysis (CCA) applied on mid-infrared spectra in the authentication of multifloral Lebanese honey. For this purpose, 96 multifloral Lebanese honey samples of different floral sources were collected from different regions of the Lebanese territory and analyzed using MIR spectroscopy. CCA applied to the spectral data, allowed a separation between honeydew honey samples and floral honey samples. In addition, honey samples collected from the Bekaa plain region were differentiated from the other honey samples collected from all the other Lebanese geographical regions. This discrimination between the groups of honey samples is based essentially on their sugar composition.
蜂蜜被认为是蜜蜂生产的优质食品。它受到世界各地消费者的高度赞赏,并引起了当今人们的主要关注,即确保其生产和植物来源的真实性。在黎巴嫩,蜂蜜主要是多花蜂蜜,这就给蜂蜜的鉴定带来了很大困难。事实证明,中红外(MIR)光谱与多元分析相结合可成功鉴定单花蜜,但黎巴嫩蜂蜜面临的挑战在于评估其在多花蜜方面的性能。因此,这项工作的目的是测试在中红外光谱上应用常见成分分析法(CCA)鉴定黎巴嫩多花蜂蜜的性能。为此,我们从黎巴嫩不同地区采集了 96 个不同花源的黎巴嫩多花蜂蜜样品,并使用中红外光谱进行了分析。将 CCA 应用于光谱数据,可以将蜜露蜂蜜样本和花蜜样本区分开来。此外,从贝卡平原地区采集的蜂蜜样品也与从黎巴嫩其他地区采集的蜂蜜样品区分开来。各组蜂蜜样品之间的区分主要基于其糖分组成。
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引用次数: 0
Collaborative Inversion of Soil Water Content in Alpine Meadow Area Based on Multitemporal Polarimetric SAR and Optical Remote Sensing Data 基于多时极坐标合成孔径雷达和光学遥感数据的高山草甸地区土壤含水量协同反演
IF 2 4区 化学 Q4 BIOCHEMICAL RESEARCH METHODS Pub Date : 2024-01-24 DOI: 10.1155/2024/2585610
Meng Kong, Xiaoqing Zuo, Yongfa Li
Soil water content is a critical environmental parameter in research and practice, though various technological and contextual constraints limit its estimation in arid areas with vegetation cover. This study combined the multitemporal remote sensing data of Sentinel-1 and Landsat 8 to conduct an inversion study on surface soil water content under low vegetation cover in Nagqu, central Tibetan Plateau. Four vegetation indices (NDVI, ARVI, EVI, and RVI) were extracted from optical remote sensing data. A water cloud model was used to eliminate the influence of the vegetation layer on the backscattering coefficient associated with vegetation cover, and a predictive model suitable for the Nagqu area was constructed. The water cloud model effectively incorporated a vegetation index instead of vegetation water content. We found that VV polarization was more suitable for soil water content inversion than VH polarization. Among the four vegetation indices, the soil water content inversion model constructed with RVI under VV polarization had the best fit (R2 = 0.8212; RMSE = 6.30). The second-best fit was observed for vegetation water content-NDVI (R2 = 0.8201). The soil water content inversion models all had an R2 > 0.6, regardless of the vegetation index used, though the RVI had the best fitting effect, indicating that this vegetation index is highly applicable in the water cloud model, as a substitute for vegetation water content, and is expected to perform well in similar study sites.
土壤含水量是研究和实践中的一个重要环境参数,但在有植被覆盖的干旱地区,各种技术和环境因素限制了对其的估算。本研究结合 Sentinel-1 和 Landsat 8 的多时相遥感数据,对青藏高原中部那曲地区低植被覆盖下的地表土壤含水量进行了反演研究。从光学遥感数据中提取了四个植被指数(NDVI、ARVI、EVI 和 RVI)。利用水云模型消除了植被层对植被覆盖反向散射系数的影响,并构建了适合那曲地区的预测模型。水云模型有效地纳入了植被指数,而不是植被含水量。我们发现 VV 偏振比 VH 偏振更适合土壤含水量反演。在四种植被指数中,在 VV 极化条件下用 RVI 构建的土壤含水量反演模型的拟合效果最好(R2 = 0.8212;RMSE = 6.30)。植被含水量-NDVI 的拟合度次之(R2 = 0.8201)。无论使用哪种植被指数,土壤含水量反演模型的 R2 都为 0.6,但 RVI 的拟合效果最好,这表明该植被指数在水云模型中的适用性很高,可替代植被含水量,预计在类似的研究地点也会有很好的表现。
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引用次数: 0
Geochemical Characterization of Sedimentary Materials (Limestone, Gypsum, Coal, and Iron Ore) along the Nile River Basin, South Wollo, Ethiopia 埃塞俄比亚南沃洛尼罗河流域沉积物(石灰石、石膏、煤炭和铁矿石)的地球化学特征描述
IF 2 4区 化学 Q4 BIOCHEMICAL RESEARCH METHODS Pub Date : 2024-01-19 DOI: 10.1155/2024/8809894
Sisay Awoke Endalew, Assamen Ayalew Ejigu, Desalegn Gezahegn Ketemu, Wudu Yimer Assen
Sedimentary rocks are produced by the weathering of preexisting rocks and the subsequent transportation and deposition of the weathering products. Among the sedimentary rocks, especially limestone is a crucial raw material for cement production. The purpose of this study was to characterize the valuable industrial raw materials, limestone, gypsum, clay, coal, and iron ore, along with the Nile River basin. For sample collection, a random sampling method was applied. Different analytical methods were carried out for complete oxide analysis such as LiBO2 fusion, HF attack, and gravimetric, calorimetric, and atomic absorption spectroscopy (AAS). The percentages of oxides detected in this study are in the range of acceptable values (high content of CaO ranging from 47.3 to 50.4% and less content of SiO2 ranging from 8.72 to 11.24%) for good proposal as a potential raw material for cement production. The most dominant and wide-range coverage of limestone along with the Nile basin, particularly near Arsema Monastery, was found as matured limestone. The petrographic analysis of gypsum, sandstone, and clay samples indicated that all the samples taken from Wegidi revealed that the high percentage of gypsum ranges from 90 to 95%. Sandstone is dominantly preset in Kelala to Jamma road along with Beto River with high content of SiO2 ranging from 61 to 95%. The results of this study indicate that the treated coal samples are relative to high calorific value, fixed carbon, and low ash content. Coal and iron ore from Jamma revealed that high calorific value is 4929.24 and hematite content is 52.2, respectively. The result of this study revealed that a huge amount of limestone reservoir is detected in Borena Wereda, Amhara, Ethiopia.
沉积岩是由先前存在的岩石风化以及随后风化产物的搬运和沉积而形成的。在沉积岩中,石灰石是水泥生产的重要原料。本研究的目的是对尼罗河流域的宝贵工业原料石灰石、石膏、粘土、煤炭和铁矿石进行特征描述。样本采集采用了随机取样法。对完整的氧化物分析采用了不同的分析方法,如 LiBO2 熔融法、HF 攻击法、重量法、量热法和原子吸收光谱法(AAS)。本研究中检测到的氧化物百分比在可接受值范围内(氧化钙含量较高,从 47.3% 到 50.4%,二氧化硅含量较低,从 8.72% 到 11.24%),可作为水泥生产的潜在原料。沿尼罗河盆地,特别是在阿尔塞马修道院附近,发现了最主要和覆盖范围最广的成熟石灰岩。对石膏、砂岩和粘土样本的岩相分析表明,在韦吉迪采集的所有样本中,石膏的比例高达 90% 至 95%。砂岩主要分布在贝托河沿岸的凯拉拉至贾马公路上,二氧化硅含量较高,在 61% 至 95% 之间。研究结果表明,经过处理的煤炭样本热值高、固定碳和灰分含量低。来自 Jamma 的煤炭和铁矿石分别显示出 4929.24 的高热值和 52.2 的赤铁矿含量。研究结果表明,在埃塞俄比亚阿姆哈拉的博雷纳韦尔达(Borena Wereda)发现了大量的石灰石储层。
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引用次数: 0
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Journal of Spectroscopy
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