1. Corrección de línea base semiautomática para espectroscopía infrarroja por transformada de Fourier (FTIR) para análisis arqueométricos.
- Author
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Nagaya, Alan, de Lucio, Oscar G., and López, Laura
- Subjects
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FOURIER transform infrared spectroscopy , *CHEBYSHEV polynomials , *FOURIER transforms , *CRYSTALLINITY , *ALGORITHMS - Abstract
Fourier transform infrared spectroscopy (FTIR) is a widely used technique that provides molecular information about the analyzed sample, which is sensitive to the analysis environment and changes in it. Therefore, when the spectrum of a material is acquired, the background must be taken into account, since it is common for the experimental parameters to be modified, the baseline varies as well. For this reason, a semi-automatic baseline correction algorithm is proposed for spectra obtained by Fourier Transform Infrared (FTIR) Spectroscopy. In which, fourth-order Chebyshev polynomials are fitted to points selected by a threshold criterion. The algorithm was applied to the analysis of CaCO3 y SiO2 mixtures, for known concentrations, showing that spectrum information is preserved. On other hand, the method was applied to verify the crystallinity of calcined bones, obtaining that the algorithm considers the shape of the bands. Preserving the physical information of the spectra and eliminating user errors. In addition to considering for band displacements. [ABSTRACT FROM AUTHOR]
- Published
- 2024
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