Combined Raman and Turbidity Probe for Real-Time Analysis of Variable Turbidity Streams

Lines, Amanda M.; Bello, Job M.; Gasbarro, Christina; Bryan, Samuel A.

doi:10.1021/acs.analchem.1c05228

Title: Combined Raman and Turbidity Probe for Real-Time Analysis of Variable Turbidity Streams

Journal Article · 16 February 2022 · Analytical Chemistry

DOI: https://doi.org/10.1021/acs.analchem.1c05228 · OSTI ID:1853802

Lines, Amanda M. ^[1]; Bello, Job M. ^[2]; Gasbarro, Christina ^[2];

^[1]

Pacific Northwest National Lab. (PNNL), Richland, WA (United States)
Spectra Solutions, Inc., Norwood, MA (United States)

We know that real-time and in situ process monitoring is a powerful tool that can empower operators of hazardous processes to better understand and control their chemical systems without increased risk to themselves. However, applying monitoring techniques to complex chemical processes can face challenges. An example of this is the application of optical spectroscopy, otherwise capable of providing detailed chemical composition information, to processes exhibiting variable turbidity. Here, details on a novel combined Raman spectroscopy and turbidimetry probe are discussed. Furthermore, the analytical approach to accurately account for both Raman signal and turbidity while quantifying chemical targets is detailed. Through leveraging Raman and turbidity data simultaneously collected from the combined probe within chemometric models, accurate quantification of multiple chemical targets can be achieved under conditions of variable concentrations and turbidity.

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Research Organization:: Pacific Northwest National Laboratory (PNNL), Richland, WA (United States)

Sponsoring Organization:: USDOE Office of Science (SC)

Grant/Contract Number:: AC05-76RL01830

OSTI ID:: 1853802

Report Number(s):: PNNL-SA-164902

Journal Information:: Analytical Chemistry, Journal Name: Analytical Chemistry Journal Issue: 8 Vol. 94; ISSN 0003-2700

Publisher:: American Chemical Society (ACS)Copyright Statement

Country of Publication:: United States

Language:: English

References (35)

An Integrated Microreactor System for Self-Optimization of a Heck Reaction: From Micro- to Mesoscale Flow Systems McMullen, Jonathan P.; Stone, Matthew T.; Buchwald, Stephen L. Angewandte Chemie International Edition, Vol. 49, Issue 39 https://doi.org/10.1002/anie.201002590	journal	August 2010
PLS works Bro, R.; Eldén, L. Journal of Chemometrics, Vol. 23, Issue 2 https://doi.org/10.1002/cem.1177	journal	February 2009
In-line and real-time process monitoring of a freeze drying process using Raman and NIR spectroscopy as complementary process analytical technology (PAT) tools De Beer, T. R. M.; Vercruysse, P.; Burggraeve, A. Journal of Pharmaceutical Sciences, Vol. 98, Issue 9 https://doi.org/10.1002/jps.21633	journal	September 2009
PLS-regression: a basic tool of chemometrics Wold, Svante; Sjöström, Michael; Eriksson, Lennart Chemometrics and Intelligent Laboratory Systems, Vol. 58, Issue 2 https://doi.org/10.1016/S0169-7439(01)00155-1	journal	October 2001
Standard error of prediction for multiway PLS Faber, Nicolaas (Klaas) M.; Bro, Rasmus Chemometrics and Intelligent Laboratory Systems, Vol. 61, Issue 1-2 https://doi.org/10.1016/S0169-7439(01)00204-0	journal	February 2002
Combinations of NIR, Raman spectroscopy and physicochemical measurements for improved monitoring of solvent extraction processes using hierarchical multivariate analysis models Nee, Ko; Bryan, Samuel A.; Levitskaia, Tatiana G. Analytica Chimica Acta, Vol. 1006 https://doi.org/10.1016/j.aca.2017.12.019	journal	May 2018
Review of on-line and near real-time spectroscopic monitoring of processes relevant to nuclear material management Tse, P.; Bryan, S. A.; Bessen, N. P. Analytica Chimica Acta, Vol. 1107 https://doi.org/10.1016/j.aca.2020.02.008	journal	April 2020
Data preprocessing for multiblock modelling – A systematization with new methods Campos, Maria P.; Reis, Marco S. Chemometrics and Intelligent Laboratory Systems, Vol. 199 https://doi.org/10.1016/j.chemolab.2020.103959	journal	April 2020
Near infrared and Raman spectroscopy for the in-process monitoring of pharmaceutical production processes De Beer, T.; Burggraeve, A.; Fonteyne, M. International Journal of Pharmaceutics, Vol. 417, Issue 1-2 https://doi.org/10.1016/j.ijpharm.2010.12.012	journal	September 2011
Limit of detection. A closer look at the IUPAC definition Long, Gary L.; Winefordner, J. D. Analytical Chemistry, Vol. 55, Issue 7 https://doi.org/10.1021/ac00258a001	journal	June 1983
Electrochemistry and Spectroelectrochemistry of Europium(III) Chloride in 3LiCl–2KCl from 643 to 1123 K Schroll, Cynthia A.; Chatterjee, Sayandev; Levitskaia, Tatiana G. Analytical Chemistry, Vol. 85, Issue 20 https://doi.org/10.1021/ac402518p	journal	September 2013
Turbidity-Corrected Raman Spectroscopy for Blood Analyte Detection Barman, Ishan; Singh, Gajendra P.; Dasari, Ramachandra R. Analytical Chemistry, Vol. 81, Issue 11 https://doi.org/10.1021/ac8025509	journal	May 2009
Importance of Using Complementary Process Analyzers for the Process Monitoring, Analysis, and Understanding of Freeze Drying De Beer, T. R. M.; Wiggenhorn, M.; Veillon, R. Analytical Chemistry, Vol. 81, Issue 18 https://doi.org/10.1021/ac9010414	journal	August 2009
Enabling Microscale Processing: Combined Raman and Absorbance Spectroscopy for Microfluidic On-Line Monitoring Nelson, Gilbert L.; Lackey, Hope E.; Bello, Job M. Analytical Chemistry, Vol. 93, Issue 3 https://doi.org/10.1021/acs.analchem.0c04225	journal	December 2020
Raman Spectroscopy Coupled with Chemometric Analysis for Speciation and Quantitative Analysis of Aqueous Phosphoric Acid Systems Clifford, Andrew J.; Lackey, Hope E.; Nelson, Gilbert L. Analytical Chemistry, Vol. 93, Issue 14 https://doi.org/10.1021/acs.analchem.1c00244	journal	March 2021
Multivariate Analysis for Quantification of Plutonium(IV) in Nitric Acid Based on Absorption Spectra Lines, Amanda M.; Adami, Susan R.; Sinkov, Sergey I. Analytical Chemistry, Vol. 89, Issue 17 https://doi.org/10.1021/acs.analchem.7b02161	journal	August 2017
Multivariate Analysis To Quantify Species in the Presence of Direct Interferents: Micro-Raman Analysis of HNO ₃ in Microfluidic Devices Lines, Amanda M.; Nelson, Gilbert L.; Casella, Amanda J. Analytical Chemistry, Vol. 90, Issue 4 https://doi.org/10.1021/acs.analchem.7b03833	journal	January 2018
Micro-Raman Technology to Interrogate Two-Phase Extraction on a Microfluidic Device Nelson, Gilbert L.; Asmussen, Susan E.; Lines, Amanda M. Analytical Chemistry, Vol. 90, Issue 14 https://doi.org/10.1021/acs.analchem.7b04330	journal	May 2018
Reimagining pH Measurement: Utilizing Raman Spectroscopy for Enhanced Accuracy in Phosphoric Acid Systems Lackey, Hope E.; Nelson, Gilbert L.; Lines, Amanda M. Analytical Chemistry, Vol. 92, Issue 8 https://doi.org/10.1021/acs.analchem.9b05708	journal	March 2020
On-Line Monitoring of Gas-Phase Molecular Iodine Using Raman and Fluorescence Spectroscopy Paired with Chemometric Analysis Felmy, Heather M.; Clifford, Andrew J.; Medina, Adan Schafer Environmental Science & Technology, Vol. 55, Issue 6 https://doi.org/10.1021/acs.est.0c06137	journal	January 2021
Quantification of Raman-Interfering Polyoxoanions for Process Analysis: Comparison of Different Chemometric Models and a Demonstration on Real Hanford Waste Tse, Poki; Shafer, Jenifer; Bryan, Samuel A. Environmental Science & Technology https://doi.org/10.1021/acs.est.1c02512	journal	September 2021
In Situ Quantification of [Re(CO) ₃ ] ⁺ by Fluorescence Spectroscopy in Simulated Hanford Tank Waste Branch, Shirmir D.; French, Amanda D.; Lines, Amanda M. Environmental Science & Technology, Vol. 52, Issue 3 https://doi.org/10.1021/acs.est.7b04222	journal	January 2018
Online, Real-Time Analysis of Highly Complex Processing Streams: Quantification of Analytes in Hanford Tank Sample Lines, A. M.; Tse, P.; Felmy, H. M. Industrial & Engineering Chemistry Research, Vol. 58, Issue 47 https://doi.org/10.1021/acs.iecr.9b03636	journal	October 2019
Overcoming Oxidation State-Dependent Spectral Interferences: Online Monitoring of U(VI) Reduction to U(IV) via Raman and UV–vis Spectroscopy Lines, Amanda M.; Hall, Gabriel B.; Sinkov, Sergey Industrial & Engineering Chemistry Research, Vol. 59, Issue 19 https://doi.org/10.1021/acs.iecr.9b06706	journal	April 2020
Sensor Fusion: Comprehensive Real-Time, On-Line Monitoring for Process Control via Visible, Near-Infrared, and Raman Spectroscopy Lines, Amanda M.; Hall, Gabriel B.; Asmussen, Susan ACS Sensors, Vol. 5, Issue 8 https://doi.org/10.1021/acssensors.0c00659	journal	July 2020
Online Monitoring of Solutions Within Microfluidic Chips: Simultaneous Raman and UV–Vis Absorption Spectroscopies Nelson, Gilbert L.; Lines, Amanda M.; Bello, Job M. ACS Sensors, Vol. 4, Issue 9 https://doi.org/10.1021/acssensors.9b00736	journal	August 2019
Absorption spectroscopy for the quantitative prediction of lanthanide concentrations in the 3LiCl–2CsCl eutectic at 723 K Schroll, Cynthia A.; Lines, Amanda M.; Heineman, William R. Analytical Methods, Vol. 8, Issue 43 https://doi.org/10.1039/C6AY01520D	journal	January 2016
Development and testing of a novel micro-Raman probe and application of calibration method for the quantitative analysis of microfluidic nitric acid streams Nelson, Gilbert L.; Lines, Amanda M.; Casella, Amanda J. The Analyst, Vol. 143, Issue 5 https://doi.org/10.1039/C7AN01761H	journal	January 2018
Measuring Nd(III) Solution Concentration in the Presence of Interfering Er(III) and Cu(II) Ions: A Partial Least Squares Analysis of Ultraviolet–Visible Spectra Tse, Poki; Shafer, Jenifer; Bryan, Samuel A. Applied Spectroscopy, Vol. 76, Issue 2 https://doi.org/10.1177/00037028211053852	journal	October 2021
Path length enhancement in disordered media for increased absorption Mupparapu, Rajeshkumar; Vynck, Kevin; Svensson, Tomas Optics Express, Vol. 23, Issue 24 https://doi.org/10.1364/OE.23.0A1472	journal	January 2015
Raman scattering and red fluorescence in the photochemical transformation of dry tryptophan particles Lai, Chih Wei; Schwab, Mark; Hill, Steven C. Optics Express, Vol. 24, Issue 11 https://doi.org/10.1364/OE.24.011654	journal	January 2016
Multivariate Curve Resolution Applied to Infrared Reflection Measurements of Soil Contaminated with an Organophosphorus Analyte Gallagher, Neal B.; Blake, Thomas A.; Gassman, Paul L. Applied Spectroscopy, Vol. 60, Issue 7 https://doi.org/10.1366/000370206777887026	journal	July 2006
Automated Autofluorescence Background Subtraction Algorithm for Biomedical Raman Spectroscopy Zhao, Jianhua; Lui, Harvey; McLean, David I. Applied Spectroscopy, Vol. 61, Issue 11 https://doi.org/10.1366/000370207782597003	journal	November 2007
Assessment and Correction of Turbidity Effects on Raman Observations of Chemicals in Aqueous Solutions Sinfield, Joseph V.; Monwuba, Chike K. Applied Spectroscopy, Vol. 68, Issue 12 https://doi.org/10.1366/13-07292	journal	December 2014
Spectroscopic monitoring of spent nuclear fuel reprocessing streams: an evaluation of spent fuel solutions via Raman, visible, and near-infrared spectroscopy Bryan, S. A.; Levitskaia, Tatiana G.; Johnsen, A. M. Radiochimica Acta, Vol. 99, Issue 9 https://doi.org/10.1524/ract.2011.1865	journal	September 2011

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