August 25th 2025
This tutorial contrasts classical analytical error propagation with modern Bayesian and resampling approaches, including bootstrapping and jackknifing. Uncertainty estimation in multivariate calibration remains an unsolved problem in spectroscopy, as traditional, Bayesian, and resampling approaches yield differing error bars for chemometric models like PLS and PCR, highlighting the need for deeper theoretical and practical solutions.
Confocal Raman AFM Imaging of Paper
June 1st 2010A better understanding of the micro- and nanostructures of cellulose fiber composition before and after various chemical treatments, together with the distribution of bleaching additives to the final paper composition, is essential for further improvements of paper properties. Confocal Raman imaging is a valuable tool for such studies, as it reveals not only optical information but also information regarding the 3D distribution of the chemical compounds in the submicrometer range. In the paper surface finishing process, additional surface roughness parameters can be measured by combining confocal Raman microscopy with atomic force microscopy. Such combined analytical microscopes allow a direct linking between high-resolution imaging and chemical identification of various species on a surface.
Raman Chemical Imaging of Explosive Contaminated Fingerprints for Forensic Applications
April 1st 2010The use of explosive devices by terrorist groups has become a constant threat in recent years. Because of this threat, the U.S. Army and other organizations are developing spectroscopic techniques to detect explosives and perform forensic examination of scenes where explosives were handled. In our group, Raman chemical imaging (RCI) is being used for forensic examination of latent fingerprints contaminated with traces of explosives. RCI has the potential to be a powerful technique both for detecting explosives and providing the biometric information necessary to identify individuals who have handled explosives.
Handheld FT-IR and Raman as Tools in the Analysis of Improvised Explosive Materials
April 1st 2010Interest in vibrational spectroscopy, principally Raman and mid-IR (FT-IR) continues to increase as these analytical techniques may be applied to a wide variety of fields, including the safety/security sector. Raman and FT-IR have seen rapid deployment for use in homeland security applications, largely due to the high chemical specificity which allows robust identification. In this article, we discuss the application of the latest portable, rugged Raman and FT-IR handhelds, enabling robust identification of explosives, TICs, TIMs, and narcotics in the field. This article introduces explosives, their different classes, and the applicability of Raman and FT-IR spectroscopy to identify their components (commercial, HMEs, and IEDs) or precursors.
Raman Spectroscopy of Documents
April 1st 2010Documents have been investigated to determine the feasibility of utilizing Raman and SERS Raman spectroscopy for the identification and characterization of inks on paper. Fluorescence reduction methods have been employed to facilitate the analysis by reducing the nascent fluorescence from paper and ink. Furthermore, ink crossings were investigated to demonstrate that ink applied after creation of a document could be differentiated from the originally applied ink.
Applications of 1064 nm Dispersive Raman Systems in Biofuel Research
February 1st 2010BaySpec, Inc. has developed a complete line of 1064 nm excitation, dispersive Raman systems that offer maximum reduction in fluorescence interference from biological samples and thus making them very useful tools for biofuel research.
Detection and Sourcing of Counterfeit Pharmaceutical Products and Consumer Goods
August 1st 2009The authors discuss the use of vibrational spectroscopy to differentiate an authentic article from a counterfeit one throughout a product's lifecycle, from component receipt at the site of manufacture, to product receipt by the end user.
Market Profile: Raman-Enabled FT-IR
June 1st 2009Infrared (IR) spectroscopy and Raman spectroscopy are very complementary methods. The strongest demand tends to come from applications that require analytical information from a potentially broad range of compounds and functional groups. The global market for combined Raman and FT-IR accounts for a small but growing percentage of both the broader IR and Raman spectroscopy markets.
Transmission Raman Offers Improved Quantitation of Pharmaceutical Solids
June 1st 2009Manufacturing control of pharmaceutical solids requires routine measurement of content uniformity. Because of the high information content in Raman spectra, it has been considered a candidate technology for making these measurements.
Analysis of Multicomponent Polymer Blends with Confocal Raman Imaging and Atomic Force Microscopy
June 1st 2009Polymer blends are designed to address the needs of different industries, and in many cases the relationship between structure, morphology, and material properties is indispensable for optimization of material design.
Combining Raman Spectroscopy and Differential Scanning Calorimetry
June 1st 2009Raman spectroscopy and differential scanning calorimetry (DSC) are powerful techniques in their own right. Combining the two techniques allows one to combine the chemical and structural information of Raman with the temperature and energetic information of DSC. This allows us to develop a greater understanding of the material. Applications from polymeric and pharmaceuticals are discussed as examples of how this can help the analyst.
Raman Spectroscopy as a Rapid Characterization Tool for Heterogeneous Solids
June 1st 2009There are many situations in which it would be highly desirable to apply the benefits of Raman to larger volumes of solid material such as powders, tablets, and composites. Raman benefits such as minimal sample preparation, the ability to provide rich information on both organics and inorganics, and its ability to measure through glass and plastic packaging make it highly amenable to these kinds of samples.
Surface-Enhanced Raman Spectroscopy: A New Approach to Rapid Identification of Intact Viruses
July 1st 2008Surface-enhanced Raman spectroscopy (SERS) has experienced an explosive resurgence in interest lately. Development of reproducible, spatially uniform SERS-active substrates has made this technique an attractive approach for identification of Raman-active compounds and biological materials including toxins, intact viruses, and intact bacterial cells–spores...
Advantages and Limitations of Modular Fiber Optics–Based Low-Resolution Raman Spectroscopy Systems
June 1st 2008Raman spectroscopy is going through a major revolution with the continuous introduction of new fiber-based modular systems for low-resolution applications. More and more scientists are discovering what Raman spectroscopy can do for their research, education, and commercial applications thanks to the low costs and flexibility this new technology is providing. New applications and prospects are presented each day, and it is important to understand the advantages and limitations that this user-friendly analytical technique can provide to address these opportunities with a scientific approach.
From Tablets to Teeth: Complete Raman Imaging
June 1st 2008Raman imaging has moved on. It is now possible to capitalize on the wealth of information available from a Raman spectrum by imaging materials over large areas, with the spatial resolution, spectral resolution, and laser excitation parameters tailored to suit each application. Raman experiments and images from a diverse range of samples are presented.
A New Forensic Tool for Chemical Identification: Raman Microscopy
June 1st 2008Chemical analysis in the forensic field is different in many aspects from other areas of analysis. The ultimate goal is to identify the sources of evidence, often by matching chemical composition. In this regard, identifying minor elements or trace impurities is as important as identifying main ingredients. In some cases, identifying minor and trace components can be critical to determining that material collected at the site of a crime is identical to material collected in a suspect's environment. In other cases, full identification of trace evidence can be important. Raman microscopy is capable of providing both types of information on minute amounts of material.
SERS Comes of Age for Molecular Detection
June 1st 2008Since it was first described in 1974, surface-enhanced Raman spectrometry (SERS) has been thought to offer significant potential for a range of different applications. The theoretical sensitivity and specificity envisaged for this powerful technique has engaged scientists for many years, but practical challenges have hindered its routine adoption. Now, a new approach combines a robust and reliable substrate with expertise in surface chemistry and molecular biology on a platform that can be adapted for a wide variety of Raman instrumentation and customized routine applications.
Automated Confocal Raman and Atomic Force Microscopy Imaging of Nanostructured Materials and Devices
June 1st 2008The combination of confocal Raman and atomic force microscopes allows chemical and surface topography imaging of large samples without any ongoing process control by an operator. This article describes the relevant measurement principles and presents examples of automated measurements on nanostructured materials.
Market Profile: Portable and Handheld Raman
June 1st 2008The continuing pace of technological advancements in scientific instruments has recently led to a wide range of commercially viable portable and handheld instruments, and the Raman spectroscopy market is no exception. While security applications have received much of the early attention in relation to handheld instruments, other applications are beginning to replace demand from the security markets.