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Automatic LIBS baseline correction by physical-constrained airPLS method: a case of equivalence ratio measurement in high temperature after-burn gas

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Abstract

When laser-induced breakdown spectroscopy (LIBS) was used in online equivalence ratio measurements, the spatial–temporal temperature gradient would lead to significantly varied baselines, which require real-time corrections. In this study, the correlation relationship between spectral intensity and broadband radiation was utilized as the physical constraint in automatic baseline correction. The pixel-to-pixel correlation coefficient on the wavelength (\({R}^{2}\)) was introduced as the “Correlation Spectrum”, and the summation of all correlation coefficients (\(sum{R}^{2}\)) was used as an objective function. By maximizing \(sum{R}^{2}\) using Particle Swarm Optimization algorithm, the key parameters in the adaptive iteratively reweighted Penalized Least Squares (airPLS) method were automatically optimized. The baselines fitted by airPLS could adapt to the plasma excitation variations in a temperature range from 1458 to 1705 K, which improved accuracy in equivalence ratio measurements. The potential advantages of Correlation Spectrum in weak peak identification and broadening effect evaluation were also demonstrated. The benchmarked results suggested that the proposed approach can be conveniently employed in online LIBS measurements and improve its quantification performance.

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Data underlying the results presented in this paper are not publicly available at this time but may be obtained from the authors upon reasonable request.

References

  1. H.M. Altay, R.L. Speth, D.E. Hudgins et al., The impact of equivalence ratio oscillations on combustion dynamics in a backward-facing step combustor. Combust. Flame 156, 2106–2116 (2009)

    Article  ADS  Google Scholar 

  2. S. Tachibana, K. Kanai, S. Yoshida et al., Combined effect of spatial and temporal variations of equivalence ratio on combustion instability in a low-swirl combustor. Proc. Combust. Inst. 35, 3299–3308 (2015)

    Article  Google Scholar 

  3. J.B. Zheng, J.H. Wang, Z.B. Zhao et al., Effect of equivalence ratio on combustion and emissions of a dual-fuel natural gas engine ignited with diesel. Appl. Therm. Eng. 146, 738–751 (2019)

    Article  Google Scholar 

  4. T. Lieuwen, B.T. Zinn, The role of equivalence ratio oscillations in driving combustion instabilities in low NOx gas turbines. In Symposium (International) on Combustion, 27(2), 1809–1816, Elsevier, 1998.

  5. B. McGann, C.D. Carter, T. Ombrello et al., Direct spectrum matching of laser-induced breakdown for concentration and gas density measurements in turbulent reacting flows. Combust. Flame 162, 4479–4485 (2015)

    Article  ADS  Google Scholar 

  6. H. Do, C.D. Carter, Q.L. Liu et al., Simultaneous gas density and fuel concentration measurements in a supersonic combustor using laser induced breakdown. Proc. Combust. Inst. 35, 2155–2162 (2015)

    Article  Google Scholar 

  7. W.D. Wu, R.L. Axelbaum, Interpreting diffusion flame structure by simultaneous mixture fraction and temperature measurements using optical and acoustic signals from laser-induced plasmas. Proc. Combust. Inst. 38, 1665–1674 (2021)

    Article  Google Scholar 

  8. L. Zimmer, S. Yoshida, Feasibility of laser-induced plasma spectroscopy for measurements of equivalence ratio in high-pressure conditions. Exp. Fluids 52, 891–904 (2012)

    Article  Google Scholar 

  9. N. Mokrani, P. Gillard, Laser induced breakdown in gas mixtures. Experimental and statistical investigation on n-decane ignition: pressure, mixture composition and equivalence ratio effects. J. Hazard. Mater. 388, 119266 (2020)

    Article  Google Scholar 

  10. B.E. Naes, S. Umpierrez, S. Ryland et al., A comparison of laser ablation inductively coupled plasma mass spectrometry, micro X-ray fluorescence spectroscopy, and laser induced breakdown spectroscopy for the discrimination of automotive glass. Spectrochim. Acta B 63, 1145–1150 (2008)

    Article  ADS  Google Scholar 

  11. L.B. Guo, D. Zhang, L.X. Sun et al., Development in the application of laser-induced breakdown spectroscopy in recent years: a review. Front. Phys. Beijing 16, 1–25 (2021)

    ADS  Google Scholar 

  12. I.B. Gornushkin, P.E. Eagan, A.B. Novikov et al., Automatic correction of continuum background in laser-induced breakdown and Raman spectrometry. Appl. Spectrosc. 57, 197–207 (2003)

    Article  ADS  Google Scholar 

  13. J. Liu, R. Zhang, X. Li et al., Continuous background correction using effective points selected in third-order minima segments in low-cost laser-induced breakdown spectroscopy without intensified CCD. Opt. Express 26, 16171–16186 (2018)

    Article  ADS  Google Scholar 

  14. F. Gan, G. Ruan, J. Mo, Baseline correction by improved iterative polynomial fitting with automatic threshold. Chemom. Intell. Lab. Syst. 82, 59–65 (2006)

    Article  Google Scholar 

  15. Y.Q. Zhang, C. Sun, Z.Q. Yue et al., Correlation-based carbon determination in steel without explicitly involving carbon-related emission lines in a LIBS spectrum. Opt. Express 28, 32019–32032 (2020)

    Article  ADS  Google Scholar 

  16. P. Yaroshchyk, J.E. Eberhardt, Automatic correction of continuum background in Laser-induced Breakdown Spectroscopy using a model-free algorithm. Spectrochim. Acta Part B At. Spectrosc. 99, 138–149 (2014)

    Article  ADS  Google Scholar 

  17. M. Friedrichs, A model-free algorithm for the removal of baseline artifacts. J. Biomol. NMR 5, 147–153 (1995)

    Article  Google Scholar 

  18. T.B. Yuan, Z. Wang, Z. Li et al., A partial least squares and wavelet-transform hybrid model to analyze carbon content in coal using laser-induced breakdown spectroscopy. Anal. Chim. Acta 807, 29–35 (2014)

    Article  Google Scholar 

  19. X.H. Zou, L.B. Guo, M. Shen et al., Accuracy improvement of quantitative analysis in laser-induced breakdown spectroscopy using modified wavelet transform. Opt. Express 22, 10233–10238 (2014)

    Article  ADS  Google Scholar 

  20. Z. Liu, R. Zheng, Y. Tian et al., A new approach for baseline correction in laser induced breakdown spectroscopy. J. Anal. At. Spectrom. 37, 1134–1140 (2022)

    Article  Google Scholar 

  21. J. Zhao, M.M. Carrabba, F.S. Allen, Automated fluorescence rejection using shifted excitation Raman difference spectroscopy. Appl. Spectrosc. 56, 834–845 (2002)

    Article  ADS  Google Scholar 

  22. M.T. Gebrekidan, C. Knipfer, F. Stelzle et al., A shifted-excitation Raman difference spectroscopy (SERDS) evaluation strategy for the efficient isolation of Raman spectra from extreme fluorescence interference. J. Raman Spectrosc. 47, 198–209 (2016)

    Article  ADS  Google Scholar 

  23. L. Sun, H. Yu, Automatic estimation of varying continuum background emission in laser-induced breakdown spectroscopy. Spectrochim. Acta Part B 64, 278–287 (2009)

    Article  ADS  Google Scholar 

  24. Z.-M. Zhang, S. Chen, Y.-Z. Liang, Baseline correction using adaptive iteratively reweighted penalized least squares. Analyst 135, 1138 (2010)

    Article  ADS  Google Scholar 

  25. Y. Li, T. Pan, H. Li et al., Non-invasive quality analysis of thawed tuna using near infrared spectroscopy with baseline correction. J. Food Process Eng. 43, e13445 (2020)

    Article  Google Scholar 

  26. M. Marín, C. Toro, L. Arias et al., Estimation of spectral emissivity and S/Cu ratio from emissions of copper concentrates at the flash smelting process. IEEE Access 7, 103346–103353 (2019)

    Article  Google Scholar 

  27. X.B. Liu, Z.M. Zhang, Y.Z. Liang et al., Baseline correction of high resolution spectral profile data based on exponential smoothing. Chemom. Intell. Lab. Syst. 139, 97–108 (2014)

    Article  Google Scholar 

  28. Z.X. Hu, B. Zou, G. Yang et al., Quantitation of surface-enhanced Raman spectroscopy based on deep learning networks. Physica B 673, 415466 (2024)

    Article  Google Scholar 

  29. N. Yang, C. Guerin, N. Kokanyan et al., Raman spectroscopy applied to online monitoring of a bioreactor: tackling the limit of detection. Spectrochim. Acta A 304, 123343 (2024)

    Article  Google Scholar 

  30. H.T. Zhang, C. Cheng, R. Gao et al., Rapid identification of cervical adenocarcinoma and cervical squamous cell carcinoma tissue based on Raman spectroscopy combined with multiple machine learning algorithms. Photodiagn. Photodyn. 33, 102104 (2021)

    Article  Google Scholar 

  31. X.X. Zheng, G.D. Lü, G.L. Du et al., Raman spectroscopy for rapid and inexpensive diagnosis of echinococcosis using the adaptive iteratively reweighted penalized least squares-Kennard-stone-back propagation neural network. Laser Phys. Lett. 15(8), 085702 (2018)

    Article  ADS  Google Scholar 

  32. J. Buday, P. Porízka, J. Kaiser, Imaging laser-induced plasma under different laser irradiances. Spectrochim. Acta B 168, 105874 (2020)

    Article  Google Scholar 

  33. V.N. Lednev, P.A. Sdvizhenskii, A.S. Dorohov et al., Improving LIBS analysis of non-flat heterogeneous samples by signals mapping. Appl. Opt. 62, 2030–2038 (2023)

    Article  ADS  Google Scholar 

  34. J. Buday, P. Porízka, M. Buchtová et al., Determination of initial expansion energy with shadowgraphy in laser-induced breakdown spectroscopy*. Spectrochim. Acta B 182, 106254 (2021)

    Article  Google Scholar 

  35. B. Chide, S. Maurice, A. Cousin et al., Recording laser-induced sparks on Mars with the SuperCam microphone. Spectrochim. Acta B 174, 106000 (2020)

    Article  Google Scholar 

  36. W. Wu, S. Chai, Y. Zhou, Monitoring the deposited energy in laser-induced plasmas with an acoustic approach. Appl. Opt. 61(7), 1734–1742 (2022)

    Article  ADS  Google Scholar 

  37. S. Chai, H.M. Peng, Z.Q. Zhao et al., A temporally-resolved investigation on energy deposition from laser-induced plasmas in combustion environments: the pre-breakdown region and breakdown initiation. Combust. Flame 249, 112612 (2023)

    Google Scholar 

  38. J. Buday, D. Prochazka, A. Zadera et al., Correlation of characteristic signals of laser-induced plasmas. Spectrochim. Acta B 194,106476 (2022)

    Article  Google Scholar 

  39. A. Hrdlicka, L. Zaorálková, M. Galiová et al., Correlation of acoustic and optical emission signals produced at 1064 and 532 nm laser-induced breakdown spectroscopy (LIBS) of glazed wall tiles. Spectrochim. Acta B 64, 74–78 (2009)

    Article  ADS  Google Scholar 

  40. P. Zhang, L. Sun, H. Yu et al., An image auxiliary method for quantitative analysis of laser-induced breakdown spectroscopy. Anal. Chem. 90, 4686–4694 (2018)

    Article  Google Scholar 

  41. C. Prüfert, T. Beitz, O. Reich et al., Inline process analysis of copper-bearing aerosols using laser-induced breakdown spectroscopy, laser-induced incandescence and optical imaging. Spectrochim. Acta B 197, 106527 (2022)

    Article  Google Scholar 

  42. J.P. Castro, E.R. Pereira-Filho, Twelve different types of data normalization for the proposition of classification, univariate and multivariate regression models for the direct analyses of alloys by laser-induced breakdown spectroscopy (LIBS). J. Anal. At. Spectrom. 31, 2005–2014 (2016)

    Article  Google Scholar 

  43. J. Kennedy and R. Eberhart, "Particle swarm optimization," Proceedings of ICNN'95 - International Conference on Neural Networks, Perth, WA, Australia, 1995, pp. 1942–1948, vol. 4. https://doi.org/10.1109/ICNN.1995.488968.

  44. Y. Shi and R. Eberhart, "A modified particle swarm optimizer," 1998 IEEE International Conference on Evolutionary Computation Proceedings. IEEE World Congress on Computational Intelligence (Cat. No.98TH8360), Anchorage, AK, USA, 1998, pp. 69–73. https://doi.org/10.1109/ICEC.1998.699146.

  45. T.M. Shami, A.A. El-Saleh, M. Alswaitti et al., Particle swarm optimization: a comprehensive survey. IEEE Access 10, 10031–10061 (2022)

    Article  Google Scholar 

  46. T.X. Phuoc, F.P. White, Laser-induced spark for measurements of the fuel-to-air ratio of a combustible mixture. Fuel 81, 1761–1765 (2002)

    Article  Google Scholar 

  47. F. Ferioli, P.V. Puzinauskas, S.G. Buckley, Laser-induced breakdown spectroscopy for on-line engine equivalence ratio measurements. Appl. Spectrosc. 57, 1183–1189 (2003)

    Article  ADS  Google Scholar 

  48. Z.F. Zhang, T. Li, X.F. Xue et al., Simultaneous measurements of fuel concentration and temperature in gas jets by laser induced breakdown spectroscopy. Spectrochim. Acta B 161, 105706 (2019)

    Article  Google Scholar 

  49. C.M. Coats, Combustion Fundamentals. R. A. Strehlow. McGraw-Hill Book Company, New York. 1984. 554 pp. Illustrated. £34.50. Aeronaut. J. 89, 162–162 (1985)

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Acknowledgements

This research was supported by National Key Research and Development Program of China (2022YFC2905500), National Natural Science Foundation of China (51906149), Natural Science Foundation of Shanghai Municipality (21DZ1205300), The Oceanic Interdisciplinary Program of Shanghai Jiao Tong University (SL2020ZD202), SJTU and SPIC: Joint Fund for Future Energy Program (202110). The authors would like to thank Aochen Li and Qiwen Zhang for their kind help.

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Conceptualization: Wendong Wu, Ziqing Zhao; methodology and formal analysis: Ziqing Zhao; investigation: Shu Chai, Haimeng Peng; writing-original draft preparation: Ziqing Zhao; writing-reviewing and editing: Wendong Wu, Chen Sun, Lijun Yu; funding acquisition: Wendong Wu, Lijun Yu, supervision: Lijun Yu; project administration: Wendong Wu.

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Correspondence to Lijun Yu.

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Wu, W., Zhao, Z., Chai, S. et al. Automatic LIBS baseline correction by physical-constrained airPLS method: a case of equivalence ratio measurement in high temperature after-burn gas. Appl. Phys. B 130, 61 (2024). https://doi.org/10.1007/s00340-024-08204-1

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