The C, Mn, Si, Cr, Ni, and Cu concentrations were calibrated from low-resolution laser-induced breakdown spectra of low-alloy steel reference standards. Multivariate calibration models for all considered elements were built based on data preprocessing in the form of normalizing spectra to the Fe II 252.0609-nm emission line and baseline correction in addition to selection of spectral variables using an original method of searching a combination of moving windows for a partial least-squares method. The characteristics of the models were a root-mean-square error and residual predictive deviation (RPD) of 0.04% and 4.7 for C (at concentrations up to 0.7%); 0.02% and 24.8 for Mn (up to 1.9%); 0.01% and 12.9 for Si (up to 0.9%); 0.01% and 21.8 for Cr (up to 1%); 0.007% and 23.3 for Ni (up to 0.7%); 0.006% and 23.2 for Cu (up to 0.5%), respectively. The models were quantitative (RPD > 3) for the six considered elements including C.
Similar content being viewed by others
References
Y. Wei, R. S. Varanasi, T. Schwarz, L. Gomell, H. Zhao, D. J. Larson, B. Sun, G. Liu, H. Chen, D. Raabe, and B. Gault, Patterns, 2, Article ID 100192 (2021).
S. Grunberger, S. Eschlbock-Fuchs, J. Hofstadler, A. Pissenberger, H. Duchaczek, S. Trautner, and J. D. Pedarnig, Spectrochim. Acta, Part B, 169, Article ID 105884 (2020).
M. W. Vaughan, P. Samimi, S. L. Gibbons, R. A. Abrahams, R. C. Harris, R. E. Barber, and I. Karaman, Scripta Mater., 184, 63–69 (2020).
Ch. J. Rao, S. Ningshen, and J. Philip, Spectrochim. Acta, Part B, 172, Article ID 105973 (2020).
L. Quackatz, A. Griesche, and T. Kannengiesser, Forces Mech., 6, Article ID 100063 (2022).
V. Motto-Ros, D. Syvilay, L. Bassel, E. Negre, F. Trichard, F. Pelascini, J. El Haddad, A. Harhira, S. Moncayo, J. Picard, D. Devismes, and B. Bousquet, Spectrochim. Acta, Part B, 140, 54–64 (2018).
T. A. Labutin, A. M. Popova, S. M. Zaytsev, N. B. Zorova, M. V. Belkov, V. V. Kiris, and S. N. Raikov, Spectrochim. Acta, Part B, 99, 94–100 (2014).
M. V. Belkov, D. A. Borisevich, K. Y. Catsalap, and M. A. Khodasevich, J. Appl. Spectrosc., 88, 970–974 (2021).
M. V. Belkov, D. A. Borisevich, K. Yu. Katsalap, and M. A. Khodasevich, Opt. Spectrosc., 10, 1611–1616 (2022).
P. Geladi and B. R. Kowalski, Anal. Chim. Acta, 185, 1–17 (1986).
S. Nawar and A. M. Mouazen, Comput. Electron. Agric., 151, 469–477 (2018).
Standard Practices for Infrared Multivariate Quantitative Analysis (ST RK ASTM E 1655–2011).
G. Schulze, A. Jirasek, M. M. L. Yu, A. Lim, R. F. B. Turner, and M. W. Blades, Appl. Spectrosc., 59, 545–574 (2005).
Z. M. Zhang, S. Chen, and Y. Z. Liang, Analyst, 135, 1138–1146 (2010).
A. A. Gomes, S. M. Azcarate, P. H. Goncalves Dias Diniz, D. D. S. Fernandes, and G. Veras, Food Chem., 370, 1–13 (2022).
Z. Xiaobo, Z. Jiewen, M. J. W. Povey, M. Holmes, and M. Hanpin, Anal. Chim. Acta, 667, 14–32 (2010).
S. F. C. Soares, A. A. Gomes, M. C. U. Araujo, A. R. G. Filho, and R. K. H. Galvao, Trends Anal. Chem., 42, 84–98 (2013).
M. Khodasevich and V. Aseev, Opt. Spectrosc., 124, 748–752 (2018).
Y. P. Du, Y. Z. Liang, J. H. Jiang, R. J. Berry, and Y. Ozaki, Anal. Chim. Acta, 501, 183–191 (2004).
R. Zornoza, C. Guerrero, J. Mataix-Solera, K. M. Scow, V. Arcenegui, and J. Mataix-Beneyto, Soil Biol. Biochem., 40, 1923–1930 (2008).
Author information
Authors and Affiliations
Corresponding author
Additional information
Translated from Zhurnal Prikladnoi Spektroskopii, Vol. 90, No. 2, pp. 174–179, March–April, 2023. https://doi.org/10.47612/0514-7506-2023-90-2-174-179.
Rights and permissions
Springer Nature or its licensor (e.g. a society or other partner) holds exclusive rights to this article under a publishing agreement with the author(s) or other rightsholder(s); author self-archiving of the accepted manuscript version of this article is solely governed by the terms of such publishing agreement and applicable law.
About this article
Cite this article
Belkov, M.V., Catsalap, K.Y., Korolko, D.A. et al. Multivariate Calibration of the Composition of Low-Alloy Steels Using Preprocessed Low-Resolution Emission Spectra with Spectral Variables Selection. J Appl Spectrosc 90, 274–278 (2023). https://doi.org/10.1007/s10812-023-01532-8
Received:
Published:
Issue Date:
DOI: https://doi.org/10.1007/s10812-023-01532-8