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用于拉曼装置孪生以实现拉曼强度协调的新协议。

New Protocol for Twinning of Raman Devices Toward a Raman Intensity Harmonization.

作者信息

Fernández-Álvarez María, Moure Alberto, Reinosa Julián Jiménez, Diz Enrique Lozano, Fernández José Francisco

机构信息

Instituto de Cerámica y Vidrio (ICV-CSIC), Madrid, Spain.

Encapsulae S.L., Castellón de la Plana, Spain.

出版信息

Appl Spectrosc. 2024 Aug;78(8):837-850. doi: 10.1177/00037028241260377. Epub 2024 Jun 14.

DOI:10.1177/00037028241260377
PMID:38876969
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC11340242/
Abstract

The use of Raman spectroscopy has rapidly been on the rise across a great number of industries where comparability, reproducibility, and reliability of the data are of paramount importance. However, controlling the intensity of the Raman signal depends on a large number of factors such as the wavelength of the laser light, the optical components of each device, or the number of molecules in the illuminated volume. For this reason, in this study, a new protocol has been applied to twin Raman devices to achieve a conversion of the signal between them, by pairing the intensity response of the units using a reference sample. The new reference material is a homogenous dispersion of a 0.5 wt% anatase (titanium dioxide, or TiO) in an epoxy resin matrix, with deviations <2.5% in Raman intensity across the reference material. The proposed protocol for Raman-twinned devices takes a well-defined approach that leads to obtaining a correction factor that relates the differences in the signal intensity between the two Raman devices, in order to obtain the same Raman intensity counts. The performance of the proposed method was evaluated based on the data from the devices, which presented the most common user cases: twinning Raman devices of the non-confocal same model for two different wavelengths; and twinning confocal and non-confocal devices. The results obtained show that the protocol has worked for both of the Raman twinning cases, allowing the Raman intensity harmonization of Raman spectra between two different devices.

摘要

拉曼光谱的应用在众多行业中迅速兴起,在这些行业中,数据的可比性、可重复性和可靠性至关重要。然而,控制拉曼信号的强度取决于大量因素,如激光的波长、每个设备的光学组件或照明体积内的分子数量。因此,在本研究中,一种新的协议已应用于双拉曼设备,通过使用参考样品将设备的强度响应配对,实现它们之间信号的转换。新的参考材料是0.5 wt%锐钛矿(二氧化钛,或TiO₂)在环氧树脂基质中的均匀分散体,整个参考材料的拉曼强度偏差<2.5%。所提出的拉曼双设备协议采用了一种明确的方法,该方法导致获得一个校正因子,该因子关联两个拉曼设备之间信号强度的差异,以便获得相同的拉曼强度计数。基于设备的数据对所提出方法的性能进行了评估,这些数据呈现了最常见的用户案例:对两个不同波长的非共焦相同型号的拉曼设备进行配对;以及对共焦和非共焦设备进行配对。获得的结果表明,该协议对两种拉曼配对情况均有效,能够实现两个不同设备之间拉曼光谱的拉曼强度协调。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ba14/11340242/4de5e455ceb5/10.1177_00037028241260377-fig5.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ba14/11340242/b41ad893d04d/10.1177_00037028241260377-img1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ba14/11340242/86315d89fc41/10.1177_00037028241260377-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ba14/11340242/4f1854452027/10.1177_00037028241260377-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ba14/11340242/2c4fabc00add/10.1177_00037028241260377-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ba14/11340242/44f60a58b847/10.1177_00037028241260377-fig4.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ba14/11340242/4de5e455ceb5/10.1177_00037028241260377-fig5.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ba14/11340242/b41ad893d04d/10.1177_00037028241260377-img1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ba14/11340242/86315d89fc41/10.1177_00037028241260377-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ba14/11340242/4f1854452027/10.1177_00037028241260377-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ba14/11340242/2c4fabc00add/10.1177_00037028241260377-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ba14/11340242/44f60a58b847/10.1177_00037028241260377-fig4.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ba14/11340242/4de5e455ceb5/10.1177_00037028241260377-fig5.jpg

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本文引用的文献

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2
Challenges in application of Raman spectroscopy to biology and materials.拉曼光谱在生物学和材料学应用中的挑战。
RSC Adv. 2018 Jul 20;8(46):25888-25908. doi: 10.1039/c8ra04491k. eCollection 2018 Jul 19.
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Review of Existing Standards, Guides, and Practices for Raman Spectroscopy.拉曼光谱现有标准、指南和实践综述。
Appl Spectrosc. 2022 Jul;76(7):747-772. doi: 10.1177/00037028221090988. Epub 2022 May 23.
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Development of a Polystyrene Reference Material for Raman Spectrometer (NMIJ RM 8158-a).聚苯乙烯基准材料的拉曼光谱仪研制(NMIJ RM 8158-a)。
Anal Sci. 2021 Nov 10;37(11):1533-1539. doi: 10.2116/analsci.21P054. Epub 2021 Apr 23.
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Comparability of Raman Spectroscopic Configurations: A Large Scale Cross-Laboratory Study.拉曼光谱配置的可比性:大规模的跨实验室研究。
Anal Chem. 2020 Dec 15;92(24):15745-15756. doi: 10.1021/acs.analchem.0c02696. Epub 2020 Nov 21.
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Baseline Assessment for the Consistency of Raman Shifts Acquired with 26 Different Raman Systems and Necessity of a Standardized Calibration Protocol.26种不同拉曼系统所采集拉曼位移的一致性基线评估及标准化校准方案的必要性
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