Applied Spectroscopy最新文献

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Characterization of Additives in Polyvinyl Chloride Using Infrared Spectroscopy and Evolved Gas Analysis-Mass Spectrometry Coupled with Two-Dimensional Correlation Spectroscopy. EXPRESS:利用红外光谱和逸出气分析-质谱联用二维相关光谱技术表征聚氯乙烯中的添加剂。
IF 2.2 3区 化学
Applied Spectroscopy Pub Date : 2026-06-01 Epub Date: 2025-11-12 DOI: 10.1177/00037028251398865
Shogo Yamane, Yasumasa Suzuki, Hideyuki Shinzawa
{"title":"Characterization of Additives in Polyvinyl Chloride Using Infrared Spectroscopy and Evolved Gas Analysis-Mass Spectrometry Coupled with Two-Dimensional Correlation Spectroscopy.","authors":"Shogo Yamane, Yasumasa Suzuki, Hideyuki Shinzawa","doi":"10.1177/00037028251398865","DOIUrl":"10.1177/00037028251398865","url":null,"abstract":"<p><p>Phthalate-based plasticizers in polyvinyl chloride (PVC) polymer were examined using infrared (IR) spectroscopy and evolved gas analysis-mass spectrometry (EGA-MS), a type of mass spectrometry (MS). IR signals arising from the C=O stretching vibrations of the plasticizers are observed but it is difficult to distinguish individual components due to their structural similarity. In contrast, temperature-dependent mass spectra of the PVC sample revealed a characteristic increase in total ion signals within the 100-220 °C range, indicating that plasticizer desorption occurs predominantly before decomposition of the PVC polymer. The application of two-dimensional correlation spectroscopy (2D-COS) to the mass spectra elucidated the detailed sequence of spectral changes during thermal desorption. The 2D correlation spectra derived from the mass spectra within the 100-220 °C range exhibited distinct correlation peaks associated with bis(2-ethylhexyl) phthalate, bis(2-ethylhexyl) adipate, and bis(2-ethylhexyl) sebacate. These results demonstrate that EGA-MS, combined with 2D-COS, can effectively identify individual additives in polymer systems.</p>","PeriodicalId":8253,"journal":{"name":"Applied Spectroscopy","volume":" ","pages":"638-644"},"PeriodicalIF":2.2,"publicationDate":"2026-06-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145493852","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"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
Advertising and Front Matter. 广告和封面。
IF 2.2 3区 化学
Applied Spectroscopy Pub Date : 2026-06-01 Epub Date: 2026-06-10 DOI: 10.1177/00037028261455169
{"title":"Advertising and Front Matter.","authors":"","doi":"10.1177/00037028261455169","DOIUrl":"https://doi.org/10.1177/00037028261455169","url":null,"abstract":"","PeriodicalId":8253,"journal":{"name":"Applied Spectroscopy","volume":"80 6","pages":"535-538"},"PeriodicalIF":2.2,"publicationDate":"2026-06-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"148209853","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"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
Combining Polarization Analysis and Isothermal Crystallization Behavior Elucidated by Two-Dimensional Correlation Spectroscopy for Understanding the Crystallization Properties of Poly[(R)-3-hydroxybutyrate-co-(R)-3-hydroxyhexanoate. EXPRESS:结合极化分析和二维相关光谱的等温结晶行为来了解聚[(R)-3-羟基丁酸盐-co-(R)-3-羟基己酸盐]的结晶性质。
IF 2.2 3区 化学
Applied Spectroscopy Pub Date : 2026-06-01 Epub Date: 2025-10-24 DOI: 10.1177/00037028251394393
Fran Adar, John Rabolt, Changhao Liu, Isao Noda
{"title":"Combining Polarization Analysis and Isothermal Crystallization Behavior Elucidated by Two-Dimensional Correlation Spectroscopy for Understanding the Crystallization Properties of Poly[(R)-3-hydroxybutyrate-<i>co</i>-(R)-3-hydroxyhexanoate.","authors":"Fran Adar, John Rabolt, Changhao Liu, Isao Noda","doi":"10.1177/00037028251394393","DOIUrl":"10.1177/00037028251394393","url":null,"abstract":"<p><p>Poly(3-hydrxybutyrate-<i>co</i>-3-hydroxyhexanoate) (PHBHx) is a biopolymer that is produced and degraded by microbes. Because of the potential to replace polymers derived from petrochemicals with these materials, there is a high level of expectation for its commercial uses if its physical and chemical properties can be understood and controlled. Among other things these properties are determined by the polymer's morphology - that is its crystallinity, and orientation of both crystalline and amorphous phases. The focus on the Raman characteristics of the crystalline phase enables elucidation of the characteristics of the polymer experiencing dynamic crystallization under various conditions. In this article we will start by reviewing the changes in the Raman spectrum from an amorphous to a crystalline material in an isothermal crystallization study. In that study a correlation field splitting between a CH stretching band that interacts with the carbonyl group on the opposite chain in the unit cell was identified. Then we will show the polarized Raman spectra of single crystals which enable an explanation of the residual amorphous material seen in the spectra of single crystals. Using the information from the single crystal measurements we can then study the Raman behavior of spherulites and confirm the model that proposes an explanation for the appearance of rings in the polarized light microscope (PLM) images of some spherulites. The polarized Raman studies confirm that the crystal ribbons that grow along the radii are twisting about the growth direction. The two-dimensional correlation spectroscopy (2D-COS) analysis of the polarized spectra of spherulites suggest the presence of strain that has been proposed to induce the twisting.</p>","PeriodicalId":8253,"journal":{"name":"Applied Spectroscopy","volume":" ","pages":"622-630"},"PeriodicalIF":2.2,"publicationDate":"2026-06-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145353558","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"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
Deviations from the Beer-Lambert Approximation Investigated Using Two-Dimensional Correlation Infrared Spectroscopy. EXPRESS:用二维相关红外光谱研究Beer-Lambert近似的偏差。
IF 2.2 3区 化学
Applied Spectroscopy Pub Date : 2026-06-01 Epub Date: 2025-08-01 DOI: 10.1177/00037028251368394
Thomas G Mayerhöfer, Susanne Pahlow, Uwe Hübner, Jürgen Popp
{"title":"Deviations from the Beer-Lambert Approximation Investigated Using Two-Dimensional Correlation Infrared Spectroscopy.","authors":"Thomas G Mayerhöfer, Susanne Pahlow, Uwe Hübner, Jürgen Popp","doi":"10.1177/00037028251368394","DOIUrl":"10.1177/00037028251368394","url":null,"abstract":"<p><p>Two-dimensional correlation spectroscopy (2D-COS) is a highly sensitive technique for detecting deviations from the Beer-Lambert approximation through asynchronous spectra. In this study, we apply 2D-COS to examine such deviations in the context of this approximation. While conventional molecular IR spectroscopy literature suggests a linear correlation between absorbance, molar concentration, and sample thickness, a more rigorous analysis, supported by electromagnetic theory, demonstrates that this assumption does not hold, even under ideal conditions. As a result, disproportionate spectral changes, caused by interference effects, give rise to distinct patterns in asynchronous 2D-COS IR spectra. To illustrate this, we investigate the thickness dependence of absorbance in poly(methyl methacrylate) (PMMA) layers deposited on calcium fluoride (CaF<sub>2</sub>) and Si. Our findings reveal systematic variations not only in absorbance values but also in band shapes and peak positions. 2D-COS emerges as a powerful tool for identifying and analyzing these patterns.</p>","PeriodicalId":8253,"journal":{"name":"Applied Spectroscopy","volume":" ","pages":"604-613"},"PeriodicalIF":2.2,"publicationDate":"2026-06-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144759010","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"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
Determination of Characteristic Bands and Correlation Filters for Two-Dimensional Correlation Spectroscopy (2D-COS). EXPRESS:确定二维相关光谱(2D-COS)的特征波段和相关滤波器。
IF 2.2 3区 化学
Applied Spectroscopy Pub Date : 2026-06-01 Epub Date: 2026-01-20 DOI: 10.1177/00037028261417374
Isao Noda
{"title":"Determination of Characteristic Bands and Correlation Filters for Two-Dimensional Correlation Spectroscopy (2D-COS).","authors":"Isao Noda","doi":"10.1177/00037028261417374","DOIUrl":"10.1177/00037028261417374","url":null,"abstract":"<p><p>Identifying characteristic bands, those exhibiting the most distinct features (i.e., minimal correlation among themselves), is a critical step in two-dimensional correlation spectroscopy (2D-COS) analysis. This process is essential for establishing effective correlation filters to simplify congested spectral datasets. Historically, such bands were selected using subjective methods, primarily the visual inspection of correlation cross-peaks. We now propose a more systematic and objective procedure based on the sequential multiplication of horizontal slices from a 2D discrimination spectrum. This unsupervised, automatic method is potentially integrable into model-free 2D-COS analyses, making it compatible with automated, machine-based interpretation.</p>","PeriodicalId":8253,"journal":{"name":"Applied Spectroscopy","volume":" ","pages":"586-594"},"PeriodicalIF":2.2,"publicationDate":"2026-06-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"146008497","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"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
Trend of Two-Dimensional Correlation Spectroscopy (2D-COS). EXPRESS:二维相关光谱(2D-COS)的发展趋势。
IF 2.2 3区 化学
Applied Spectroscopy Pub Date : 2026-06-01 Epub Date: 2025-08-08 DOI: 10.1177/00037028251369892
Yeonju Park, Sujin Lee, Isao Noda, Young Mee Jung
{"title":"Trend of Two-Dimensional Correlation Spectroscopy (2D-COS).","authors":"Yeonju Park, Sujin Lee, Isao Noda, Young Mee Jung","doi":"10.1177/00037028251369892","DOIUrl":"10.1177/00037028251369892","url":null,"abstract":"<p><p>This comprehensive survey review offers the trajectory of research dissemination in the field of two-dimensional correlation spectroscopy (2D-COS) from 1 July 2022 to 17 June 2024. It covers books, reviews, tutorials, innovative concepts and theories, patents applications, and diverse applications that emerged during this period, as well as instances of improper usage or citations of 2D-COS. Innovations in probe integration, data analysis, and technical methodologies highlight the expanding role of 2D-COS in materials science, environmental monitoring, and biological system. This review shows the dynamic growth and diversification of 2D-COS across in many scientific fields.</p>","PeriodicalId":8253,"journal":{"name":"Applied Spectroscopy","volume":" ","pages":"539-576"},"PeriodicalIF":2.2,"publicationDate":"2026-06-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144803301","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"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
Surface-Bulk Correlation Spectroscopy for the Characterization of Ternary Adsorption. 表征三元吸附的表面-体相关光谱。
IF 2.2 3区 化学
Applied Spectroscopy Pub Date : 2026-06-01 Epub Date: 2025-06-30 DOI: 10.1177/00037028251350675
Mahsa Torkamanasadi, Dennis K Hore
{"title":"Surface-Bulk Correlation Spectroscopy for the Characterization of Ternary Adsorption.","authors":"Mahsa Torkamanasadi, Dennis K Hore","doi":"10.1177/00037028251350675","DOIUrl":"10.1177/00037028251350675","url":null,"abstract":"<p><p>A method is proposed whereby the range of equilibrium constants that describe how a ternary mixture of molecules is adsorbed onto a solid substrate may be obtained. This information may then be related to the surface preference of a particular species. The technique utilizes infrared and/or Raman spectra of the bulk phase, together with sum frequency generation spectra of the surface in a heterospectral two-dimensional correlation analysis. The method consists of a series of up to three experiments in which the bulk concentrations are varied, followed by a set of rules for interpreting the resulting correlation maps to identify adsorption sequences and surface preference. A scheme is provided to direct the design of the experiments and analyses for such multi-component mixtures.</p>","PeriodicalId":8253,"journal":{"name":"Applied Spectroscopy","volume":" ","pages":"577-585"},"PeriodicalIF":2.2,"publicationDate":"2026-06-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.ncbi.nlm.nih.gov/pmc/articles/PMC13250274/pdf/","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144526204","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Two-Trace Two-Dimensional (2T2D) Correlation Spectroscopy of Lymphocytes in Infectious Mononucleosis. 传染性单核细胞增多症患者淋巴细胞的双迹二维(2T2D)相关光谱。
IF 2.2 3区 化学
Applied Spectroscopy Pub Date : 2026-06-01 Epub Date: 2026-05-16 DOI: 10.1177/00037028261449822
Natalia Stach, Aleksandra Kurek, Magdalena Pietruszewska, Grażyna Biesiada, Jacek Czepiel, Malwina Birczyńska-Zych, Paulina Moskal, Monika Bociąga-Jasik, Aleksandra Wesełucha-Birczyńska
{"title":"Two-Trace Two-Dimensional (2T2D) Correlation Spectroscopy of Lymphocytes in Infectious Mononucleosis.","authors":"Natalia Stach, Aleksandra Kurek, Magdalena Pietruszewska, Grażyna Biesiada, Jacek Czepiel, Malwina Birczyńska-Zych, Paulina Moskal, Monika Bociąga-Jasik, Aleksandra Wesełucha-Birczyńska","doi":"10.1177/00037028261449822","DOIUrl":"10.1177/00037028261449822","url":null,"abstract":"<p><p>Raman spectroscopy has been widely demonstrated as a powerful tool for analyzing macromolecules characteristic of living organisms. This research focuses on a detailed spectroscopic analysis of lymphocytes affected by infectious mononucleosis caused by Epstein-Barr virus (EBV, HHV-4). As shown, at least 98% of the population is infected with EBV, making it one of the most common viruses. The main aim of this study is to evaluate the capability of Raman spectroscopy to distinguish between healthy lymphocytes from those infected with EBV at an early stage of infection. Blood samples were collected from patients with infectious mononucleosis who were receiving treatment at the University Hospital in Kraków. For comparative purposes, samples from healthy volunteers were also included. To guarantee detailed analysis, Raman spectra were acquired using two excitation wavelengths: 514.5 nm and 785 nm. The two-trace two-dimensional (2T2D) correlation method was performed to recognize the difference between EBV-infected and healthy cells. Initially, mean Raman spectra were calculated for healthy and infected cells and subsequently used to generate synchronous and asynchronous 2T2D correlation maps. Analysis of the asynchronous correlation spectra reveals distinct differences between healthy and diseased lymphocytes for both excitation wavelengths. For example, asynchronous peaks at 514.5 nm excitation indicate the beginning of immunoglobulin formation, while at 785 nm excitation indicate Tyrosine phosphorylation, which corresponds to activation of lymphocytes. The detection of specific biochemical alterations shows the potential of Raman spectroscopy as a non-invasive diagnostic tool in viral infections.</p>","PeriodicalId":8253,"journal":{"name":"Applied Spectroscopy","volume":" ","pages":"645-653"},"PeriodicalIF":2.2,"publicationDate":"2026-06-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"147959297","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"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
Two-Dimensional (2D) Polarized Near-Infrared (NIR) Correlation Spectroscopy for Characterizing Reorientation of Low-Density Polyethylene (LDPE). EXPRESS:二维(2D)偏振近红外(NIR)相关光谱表征低密度聚乙烯(LDPE)重定向。
IF 2.2 3区 化学
Applied Spectroscopy Pub Date : 2026-06-01 Epub Date: 2026-02-16 DOI: 10.1177/00037028261426391
Hideyuki Shinzawa
{"title":"Two-Dimensional (2D) Polarized Near-Infrared (NIR) Correlation Spectroscopy for Characterizing Reorientation of Low-Density Polyethylene (LDPE).","authors":"Hideyuki Shinzawa","doi":"10.1177/00037028261426391","DOIUrl":"10.1177/00037028261426391","url":null,"abstract":"<p><p>A polarized near-infrared (NIR) study for characterizing the orientation distribution of polymer chains is described. A low-density polyethylene (LDPE) sheet prepared with a hot rolling press is gradually rotated while being probed with a high-speed polarized NIR spectrometer based on an acousto-optic tunable filter (AOTF) to obtain a series of NIR spectra. During the change in the rotation angle, the spectral feature varies depending on the direction of the molecular vibration within the sample. The fine features of the spectral changes are readily analyzed with the two-trace two-dimensional (2T2D) correlation method by using the spectrum measured at 0° as a sample spectrum. The asynchronous correlation intensities between the crystalline and amorphous bands of the LDPE exhibited a sinusoidal variation depending on the selected reference spectrum (i.e., polarization angle). In particular, the intensities provide local maximum points at 90° and 270° where the direction of the polarized NIR light becomes parallel to the hot rolling direction. Consequently, the cyclic pattern of the asynchronous correlation intensity suggests that the hot rolling treatment substantially induces the reorientation of the polymer chains and subsequent additional crystallization, which makes the LDPE hard and brittle.</p>","PeriodicalId":8253,"journal":{"name":"Applied Spectroscopy","volume":" ","pages":"631-637"},"PeriodicalIF":2.2,"publicationDate":"2026-06-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"146206511","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"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
Spectroscopic Study of Solution Crystallization of a Biodegradable Polyester Streamlined with a Correlation Filter (CF). EXPRESS:具有相关过滤器(CF)的生物可降解聚酯流线型溶液结晶的光谱研究。
IF 2.2 3区 化学
Applied Spectroscopy Pub Date : 2026-06-01 Epub Date: 2025-08-11 DOI: 10.1177/00037028251370762
Yeonju Park, Young Mee Jung, Isao Noda
{"title":"Spectroscopic Study of Solution Crystallization of a Biodegradable Polyester Streamlined with a Correlation Filter (CF).","authors":"Yeonju Park, Young Mee Jung, Isao Noda","doi":"10.1177/00037028251370762","DOIUrl":"10.1177/00037028251370762","url":null,"abstract":"<p><p>Due to the growing interest in high-purity bioplastics for emerging applications, we investigated the solution crystallization of poly(3-hydroxybutyrate-<i>co</i>-3-hydroxyhexanoate) (PHBHx) from a chloroform solution using advanced spectroscopic techniques. Compared to melt crystallization, solution crystallization proved to be a more complex process. Solvent evaporation led to the formation of amorphous PHBHx and less-ordered crystallites. Subsequently, a distinct intermediate species of slightly disordered crystals formed, eventually transforming into more ordered crystalline structures. To analyze the time-dependent attenuated total reflection infrared (ATR-IR) spectra during crystallization, we employed two-dimensional correlation spectroscopy (2D-COS) and codistribution spectroscopy (2D-CDS). To streamline the 2D analysis of this complex dynamic system, we utilized a correlation filter (CF) technique to attenuate interfering contributions from overlapping peaks.</p>","PeriodicalId":8253,"journal":{"name":"Applied Spectroscopy","volume":" ","pages":"595-603"},"PeriodicalIF":2.2,"publicationDate":"2026-06-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144815738","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"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
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