@Article{BaDuMaPiCrBa:2022:DePrAp,
author = "Ba, Elhadji Cheikh Talibouya and Dumont, Marcello Rosa and
Martins, Paulo S{\'e}rgio and Pinheiro, B{\'a}rbara da Silva and
Cruz, Matheus Philippe Martins da and Barbosa, Jorge Wanderson",
affiliation = "{Centro Federal de Educa{\c{c}}{\~a}o Tecnol{\'o}gica de Minas
Gerais (CEFETMG)} and {Centro Federal de Educa{\c{c}}{\~a}o
Tecnol{\'o}gica de Minas Gerais (CEFETMG)} and
{Pontif{\'{\i}}cia Universidade Cat{\'o}lica de Minas Gerais
(PUC-Minas)} and {Instituto Nacional de Pesquisas Espaciais
(INPE)} and {Universidade Federal de Minas Gerais (UFMG)} and
{Centro Federal de Educa{\c{c}}{\~a}o Tecnol{\'o}gica de Minas
Gerais (CEFETMG)}",
title = "Deconvolution process approach in Raman spectra of DLC coating to
determine the sp3 hybridization content using the ID/IG ratio in
relation to the quantification determined by X-ray photoelectron
spectroscopy",
journal = "Diamond and Related Materials",
year = "2022",
volume = "122",
pages = "e108818",
month = "Feb.",
keywords = "Deconvolution, Diamond-like carbon, Mathematical model, Raman
spectroscopy, Statistics, X-ray photoelectron spectroscopy.",
abstract = "Raman spectroscopy has contributed to many fields of materials
science, for example, in studies addressing Diamond-Like Carbon
coatings. In the literature, discussions have arisen due to the
various interpretations of Raman spectra and some studies have not
recommended using it to measure sp2 and sp3 hybridization
contents. This article addresses the deconvolution process in
Raman spectra, manipulating the Raman shift interval, the presence
of Savitzky-Golay smoothing and the appearance of additional
bands. X-ray photoelectron spectroscopy was used to quantify the
sp2 and sp3 contents, which are discussed below in relation to the
ID/IG ratio and the prediction of the amorphization trajectory of
graphite. In an attempt to find a relationship between these
characterization techniques, a polynomial equation was developed
from thirty-three experimental results researched in the
literature. The results indicated a coating belonging to the a-C:H
class containing 18% of sp3. The relationship between the
spectroscopies was complementary and the graphite amorphization
trajectory was assertive. The coefficient of determination and the
standard deviation proved to be useful parameters for selecting
the representative spectrum of the coating. Neglecting or not the
appearance of an additional band can provide modifications to the
ID/IG ratio at the level of 52%. Representative results of the
ID/IG ratio indicated the hypothesis of considering the intensity
of the bands only as a function of height. The sp3 content
predicted by the equation was maximized to any selected ID/IG
value when the G Band was centered at approximately 1559
cm\−1. It was observed that the equation can be used
qualitatively with less errors in conditions where the
deconvolutions present parameters similar to the experimental
results whose sp3 content is between 20% and 39.9%.",
doi = "10.1016/j.diamond.2021.108818",
url = "http://dx.doi.org/10.1016/j.diamond.2021.108818",
issn = "0925-9635",
language = "en",
targetfile = "deconvolution_2022.pdf",
urlaccessdate = "25 jun. 2024"
}