MCR-ALS aplicado no monitoramento quantitativo do processo de eletrodegradação da atrazina usando espectros UV : resultados comparativos com HPLC-DAD como um método de referência.

Detalhes bibliográficos
Autor(a) principal: Souza, Thálisson Santos
Data de Publicação: 2016
Outros Autores: Zanin, Hudson Giovani, Peterlevitz, Alfredo Carlos, Baranauskas, Vitor, Silva, Gilmare Antônia da, Reis, Cesar, Reis, Efraim Lázaro, Teófilo, Reinaldo Francisco
Tipo de documento: Artigo
Idioma: por
Título da fonte: Repositório Institucional da UFOP
Texto Completo: http://www.repositorio.ufop.br/handle/123456789/6698
http://dx.doi.org/10.5935/0100-4042.20160006
Resumo: Electrodegradation of atrazine in water was performed using homemade (PA and PB) and purchased (PC) boron-doped diamond anodes. The degradation was monitored off-line by analyzing total organic carbon and high performance liquid chromatography with diode array detector (HPLC-DAD) and at-line by UV spectroscopy. The spectra were recorded every 2 min. The rank deficiency problem was resolved by assembling an augmented column-wise matrix. HPLC was employed to separate the original and byproducts degradation components. Aiming the same goal, multivariate curve resolution – alternating least squares (MCR-ALS) was applied to resolve the UV spectroscopic data. Comparison between HPLC and MCR-ALS separations is presented. By using MCR-ALS the spectra of atrazine and two byproducts were successfully resolved and the resulted concentration profiles properly represented the system studied. The ALS explained variance (R2) for PA, PB and PC was equal to 99.99% for all of them and the lack of fit for PA, PB and PC were 0.39, 0.34 and 0.54 respectively. The correlation (R) between the recovered and pure spectra were calculate for each electrodegradation, validating the MCR-ALS results. The average R was equal to 0.997. The spectral and concentration profiles described with this new approach are in agreement with HPLC-DAD results. The proposed method is an alternative to classical analyses for monitoring of the degradation process, mainly due to the simplicity, fast results and economy.
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spelling Souza, Thálisson SantosZanin, Hudson GiovaniPeterlevitz, Alfredo CarlosBaranauskas, VitorSilva, Gilmare Antônia daReis, CesarReis, Efraim LázaroTeófilo, Reinaldo Francisco2016-07-29T16:58:04Z2016-07-29T16:58:04Z2016SOUZA, T. S. et al. MCR-ALS aplicado no monitoramento quantitativo do processo de eletrodegradação da atrazina usando espectros UV: resultados comparativos com HPLC-DAD como um método de referência. Química Nova, v. 39, p. 137-45, 2016. Disponível em: <http://www.scielo.br/pdf/qn/v39n2/0100-4042-qn-39-02-0137.pdf>. Acesso em: 16 jun. 2016.1678-7064http://www.repositorio.ufop.br/handle/123456789/6698http://dx.doi.org/10.5935/0100-4042.20160006Electrodegradation of atrazine in water was performed using homemade (PA and PB) and purchased (PC) boron-doped diamond anodes. The degradation was monitored off-line by analyzing total organic carbon and high performance liquid chromatography with diode array detector (HPLC-DAD) and at-line by UV spectroscopy. The spectra were recorded every 2 min. The rank deficiency problem was resolved by assembling an augmented column-wise matrix. HPLC was employed to separate the original and byproducts degradation components. Aiming the same goal, multivariate curve resolution – alternating least squares (MCR-ALS) was applied to resolve the UV spectroscopic data. Comparison between HPLC and MCR-ALS separations is presented. By using MCR-ALS the spectra of atrazine and two byproducts were successfully resolved and the resulted concentration profiles properly represented the system studied. The ALS explained variance (R2) for PA, PB and PC was equal to 99.99% for all of them and the lack of fit for PA, PB and PC were 0.39, 0.34 and 0.54 respectively. The correlation (R) between the recovered and pure spectra were calculate for each electrodegradation, validating the MCR-ALS results. The average R was equal to 0.997. The spectral and concentration profiles described with this new approach are in agreement with HPLC-DAD results. The proposed method is an alternative to classical analyses for monitoring of the degradation process, mainly due to the simplicity, fast results and economy.A Sociedade Brasileira de Química dá permissão à UFOP para reproduzir no RI/UFOP, uma cópia em formato eletrônico dos artigos completos, sem nenhuma edição e/ou modificação, publicados na revista Química Nova, que tenham como autores seus alunos e/ou professores. Fonte: Email do editor de 17 set. 2013.info:eu-repo/semantics/openAccessElectrodegradationBoron doped diamondAtrazineMultivariate curve resolution alternating least squaresMCR-ALS aplicado no monitoramento quantitativo do processo de eletrodegradação da atrazina usando espectros UV : resultados comparativos com HPLC-DAD como um método de referência.MCR - ALS applied to the quantitative monitoring of the electrodegradation process of atrazine using UV spectra : comparative results with HPLC - DAD as a reference method.info:eu-repo/semantics/publishedVersioninfo:eu-repo/semantics/articleporreponame:Repositório Institucional da UFOPinstname:Universidade Federal de Ouro Preto (UFOP)instacron:UFOPLICENSElicense.txtlicense.txttext/plain; charset=utf-8924http://www.repositorio.ufop.br/bitstream/123456789/6698/2/license.txt62604f8d955274beb56c80ce1ee5dcaeMD52ORIGINALARTIGO_MCRALSAplicado.pdfARTIGO_MCRALSAplicado.pdfapplication/pdf4725851http://www.repositorio.ufop.br/bitstream/123456789/6698/1/ARTIGO_MCRALSAplicado.pdfe64f25429d7a0a58807560925846d9f4MD51123456789/66982019-09-23 10:40:23.654oai:localhost: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ório InstitucionalPUBhttp://www.repositorio.ufop.br/oai/requestrepositorio@ufop.edu.bropendoar:32332019-09-23T14:40:23Repositório Institucional da UFOP - Universidade Federal de Ouro Preto (UFOP)false
dc.title.pt_BR.fl_str_mv MCR-ALS aplicado no monitoramento quantitativo do processo de eletrodegradação da atrazina usando espectros UV : resultados comparativos com HPLC-DAD como um método de referência.
dc.title.alternative.pt_BR.fl_str_mv MCR - ALS applied to the quantitative monitoring of the electrodegradation process of atrazine using UV spectra : comparative results with HPLC - DAD as a reference method.
title MCR-ALS aplicado no monitoramento quantitativo do processo de eletrodegradação da atrazina usando espectros UV : resultados comparativos com HPLC-DAD como um método de referência.
spellingShingle MCR-ALS aplicado no monitoramento quantitativo do processo de eletrodegradação da atrazina usando espectros UV : resultados comparativos com HPLC-DAD como um método de referência.
Souza, Thálisson Santos
Electrodegradation
Boron doped diamond
Atrazine
Multivariate curve resolution alternating least squares
title_short MCR-ALS aplicado no monitoramento quantitativo do processo de eletrodegradação da atrazina usando espectros UV : resultados comparativos com HPLC-DAD como um método de referência.
title_full MCR-ALS aplicado no monitoramento quantitativo do processo de eletrodegradação da atrazina usando espectros UV : resultados comparativos com HPLC-DAD como um método de referência.
title_fullStr MCR-ALS aplicado no monitoramento quantitativo do processo de eletrodegradação da atrazina usando espectros UV : resultados comparativos com HPLC-DAD como um método de referência.
title_full_unstemmed MCR-ALS aplicado no monitoramento quantitativo do processo de eletrodegradação da atrazina usando espectros UV : resultados comparativos com HPLC-DAD como um método de referência.
title_sort MCR-ALS aplicado no monitoramento quantitativo do processo de eletrodegradação da atrazina usando espectros UV : resultados comparativos com HPLC-DAD como um método de referência.
author Souza, Thálisson Santos
author_facet Souza, Thálisson Santos
Zanin, Hudson Giovani
Peterlevitz, Alfredo Carlos
Baranauskas, Vitor
Silva, Gilmare Antônia da
Reis, Cesar
Reis, Efraim Lázaro
Teófilo, Reinaldo Francisco
author_role author
author2 Zanin, Hudson Giovani
Peterlevitz, Alfredo Carlos
Baranauskas, Vitor
Silva, Gilmare Antônia da
Reis, Cesar
Reis, Efraim Lázaro
Teófilo, Reinaldo Francisco
author2_role author
author
author
author
author
author
author
dc.contributor.author.fl_str_mv Souza, Thálisson Santos
Zanin, Hudson Giovani
Peterlevitz, Alfredo Carlos
Baranauskas, Vitor
Silva, Gilmare Antônia da
Reis, Cesar
Reis, Efraim Lázaro
Teófilo, Reinaldo Francisco
dc.subject.por.fl_str_mv Electrodegradation
Boron doped diamond
Atrazine
Multivariate curve resolution alternating least squares
topic Electrodegradation
Boron doped diamond
Atrazine
Multivariate curve resolution alternating least squares
description Electrodegradation of atrazine in water was performed using homemade (PA and PB) and purchased (PC) boron-doped diamond anodes. The degradation was monitored off-line by analyzing total organic carbon and high performance liquid chromatography with diode array detector (HPLC-DAD) and at-line by UV spectroscopy. The spectra were recorded every 2 min. The rank deficiency problem was resolved by assembling an augmented column-wise matrix. HPLC was employed to separate the original and byproducts degradation components. Aiming the same goal, multivariate curve resolution – alternating least squares (MCR-ALS) was applied to resolve the UV spectroscopic data. Comparison between HPLC and MCR-ALS separations is presented. By using MCR-ALS the spectra of atrazine and two byproducts were successfully resolved and the resulted concentration profiles properly represented the system studied. The ALS explained variance (R2) for PA, PB and PC was equal to 99.99% for all of them and the lack of fit for PA, PB and PC were 0.39, 0.34 and 0.54 respectively. The correlation (R) between the recovered and pure spectra were calculate for each electrodegradation, validating the MCR-ALS results. The average R was equal to 0.997. The spectral and concentration profiles described with this new approach are in agreement with HPLC-DAD results. The proposed method is an alternative to classical analyses for monitoring of the degradation process, mainly due to the simplicity, fast results and economy.
publishDate 2016
dc.date.accessioned.fl_str_mv 2016-07-29T16:58:04Z
dc.date.available.fl_str_mv 2016-07-29T16:58:04Z
dc.date.issued.fl_str_mv 2016
dc.type.status.fl_str_mv info:eu-repo/semantics/publishedVersion
dc.type.driver.fl_str_mv info:eu-repo/semantics/article
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status_str publishedVersion
dc.identifier.citation.fl_str_mv SOUZA, T. S. et al. MCR-ALS aplicado no monitoramento quantitativo do processo de eletrodegradação da atrazina usando espectros UV: resultados comparativos com HPLC-DAD como um método de referência. Química Nova, v. 39, p. 137-45, 2016. Disponível em: <http://www.scielo.br/pdf/qn/v39n2/0100-4042-qn-39-02-0137.pdf>. Acesso em: 16 jun. 2016.
dc.identifier.uri.fl_str_mv http://www.repositorio.ufop.br/handle/123456789/6698
dc.identifier.issn.none.fl_str_mv 1678-7064
dc.identifier.doi.none.fl_str_mv http://dx.doi.org/10.5935/0100-4042.20160006
identifier_str_mv SOUZA, T. S. et al. MCR-ALS aplicado no monitoramento quantitativo do processo de eletrodegradação da atrazina usando espectros UV: resultados comparativos com HPLC-DAD como um método de referência. Química Nova, v. 39, p. 137-45, 2016. Disponível em: <http://www.scielo.br/pdf/qn/v39n2/0100-4042-qn-39-02-0137.pdf>. Acesso em: 16 jun. 2016.
1678-7064
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http://dx.doi.org/10.5935/0100-4042.20160006
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