Vibrational spectroscopic characterization of the sulphate mineral leightonite K2Ca2Cu(SO4)4 2H2O : implications for the molecular structure.

Detalhes bibliográficos
Autor(a) principal: Frost, Ray Leslie
Data de Publicação: 2013
Outros Autores: López, Andrés, Xi, Yunfei, Cipriano, Ricardo Augusto Scholz, Graça, Leonardo Martins, Lagoeiro, Leonardo Evangelista
Tipo de documento: Artigo
Idioma: eng
Título da fonte: Repositório Institucional da UFOP
Texto Completo: http://www.repositorio.ufop.br/handle/123456789/3880
https://doi.org/10.1016/j.saa.2013.04.030
Resumo: The mineral leightonite, a rare sulphate mineral of formula K2Ca2Cu(SO4)4.2H2O, has been studied using a combination of electron probe and vibrational spectroscopy. The mineral is characterized by an intense Raman band at 991 cm^-1 attributed to the SO4^-2 m1 symmetric stretching mode. A series of Raman bands at 1047, 1120, 1137, 1163 and 1177 cm^-1 assigned to the SO4^-2 m3 antisymmetric stretching modes. The observation of multiple bands shows that the symmetry of the sulphate anion is reduced. Multiple Raman and infrared bands in the OH stretching region shows that water in the structure of leightonite is in a range of molecular environments.
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spelling Frost, Ray LeslieLópez, AndrésXi, YunfeiCipriano, Ricardo Augusto ScholzGraça, Leonardo MartinsLagoeiro, Leonardo Evangelista2014-11-14T20:12:52Z2014-11-14T20:12:52Z2013FROST, RAY L. et al. Vibrational spectroscopic characterization of the sulphate mineral leightonite K2Ca2Cu(SO4)4 2H2O : implications for the molecular structure. Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy, v. 112, p. 90-94, 2013. Disponível em: <http://www.sciencedirect.com/science/article/pii/S1386142513003545>. Acesso em: 30 set. 2014.1386-1425http://www.repositorio.ufop.br/handle/123456789/3880https://doi.org/10.1016/j.saa.2013.04.030The mineral leightonite, a rare sulphate mineral of formula K2Ca2Cu(SO4)4.2H2O, has been studied using a combination of electron probe and vibrational spectroscopy. The mineral is characterized by an intense Raman band at 991 cm^-1 attributed to the SO4^-2 m1 symmetric stretching mode. A series of Raman bands at 1047, 1120, 1137, 1163 and 1177 cm^-1 assigned to the SO4^-2 m3 antisymmetric stretching modes. The observation of multiple bands shows that the symmetry of the sulphate anion is reduced. Multiple Raman and infrared bands in the OH stretching region shows that water in the structure of leightonite is in a range of molecular environments.LeightoniteSulphateMolecular structureRaman spectroscopyInfrared spectroscopyVibrational spectroscopic characterization of the sulphate mineral leightonite K2Ca2Cu(SO4)4 2H2O : implications for the molecular structure.info:eu-repo/semantics/publishedVersioninfo:eu-repo/semantics/articleO periódico Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy concede permissão para depósito deste artigo no Repositório Institucional da UFOP. Número da licença: 3481460482865.info:eu-repo/semantics/openAccessengreponame:Repositório Institucional da UFOPinstname:Universidade Federal de Ouro Preto (UFOP)instacron:UFOPLICENSElicense.txtlicense.txttext/plain; charset=utf-81748http://www.repositorio.ufop.br/bitstream/123456789/3880/2/license.txt8a4605be74aa9ea9d79846c1fba20a33MD52ORIGINALARTIGO_VibrationalSpectroscopicSulphate.pdfARTIGO_VibrationalSpectroscopicSulphate.pdfapplication/pdf1095118http://www.repositorio.ufop.br/bitstream/123456789/3880/1/ARTIGO_VibrationalSpectroscopicSulphate.pdfb296f5c1e22d59d87c9b88eb4ce67ca3MD51123456789/38802019-07-09 09:43:57.033oai:localhost: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Repositório InstitucionalPUBhttp://www.repositorio.ufop.br/oai/requestrepositorio@ufop.edu.bropendoar:32332019-07-09T13:43:57Repositório Institucional da UFOP - Universidade Federal de Ouro Preto (UFOP)false
dc.title.pt_BR.fl_str_mv Vibrational spectroscopic characterization of the sulphate mineral leightonite K2Ca2Cu(SO4)4 2H2O : implications for the molecular structure.
title Vibrational spectroscopic characterization of the sulphate mineral leightonite K2Ca2Cu(SO4)4 2H2O : implications for the molecular structure.
spellingShingle Vibrational spectroscopic characterization of the sulphate mineral leightonite K2Ca2Cu(SO4)4 2H2O : implications for the molecular structure.
Frost, Ray Leslie
Leightonite
Sulphate
Molecular structure
Raman spectroscopy
Infrared spectroscopy
title_short Vibrational spectroscopic characterization of the sulphate mineral leightonite K2Ca2Cu(SO4)4 2H2O : implications for the molecular structure.
title_full Vibrational spectroscopic characterization of the sulphate mineral leightonite K2Ca2Cu(SO4)4 2H2O : implications for the molecular structure.
title_fullStr Vibrational spectroscopic characterization of the sulphate mineral leightonite K2Ca2Cu(SO4)4 2H2O : implications for the molecular structure.
title_full_unstemmed Vibrational spectroscopic characterization of the sulphate mineral leightonite K2Ca2Cu(SO4)4 2H2O : implications for the molecular structure.
title_sort Vibrational spectroscopic characterization of the sulphate mineral leightonite K2Ca2Cu(SO4)4 2H2O : implications for the molecular structure.
author Frost, Ray Leslie
author_facet Frost, Ray Leslie
López, Andrés
Xi, Yunfei
Cipriano, Ricardo Augusto Scholz
Graça, Leonardo Martins
Lagoeiro, Leonardo Evangelista
author_role author
author2 López, Andrés
Xi, Yunfei
Cipriano, Ricardo Augusto Scholz
Graça, Leonardo Martins
Lagoeiro, Leonardo Evangelista
author2_role author
author
author
author
author
dc.contributor.author.fl_str_mv Frost, Ray Leslie
López, Andrés
Xi, Yunfei
Cipriano, Ricardo Augusto Scholz
Graça, Leonardo Martins
Lagoeiro, Leonardo Evangelista
dc.subject.por.fl_str_mv Leightonite
Sulphate
Molecular structure
Raman spectroscopy
Infrared spectroscopy
topic Leightonite
Sulphate
Molecular structure
Raman spectroscopy
Infrared spectroscopy
description The mineral leightonite, a rare sulphate mineral of formula K2Ca2Cu(SO4)4.2H2O, has been studied using a combination of electron probe and vibrational spectroscopy. The mineral is characterized by an intense Raman band at 991 cm^-1 attributed to the SO4^-2 m1 symmetric stretching mode. A series of Raman bands at 1047, 1120, 1137, 1163 and 1177 cm^-1 assigned to the SO4^-2 m3 antisymmetric stretching modes. The observation of multiple bands shows that the symmetry of the sulphate anion is reduced. Multiple Raman and infrared bands in the OH stretching region shows that water in the structure of leightonite is in a range of molecular environments.
publishDate 2013
dc.date.issued.fl_str_mv 2013
dc.date.accessioned.fl_str_mv 2014-11-14T20:12:52Z
dc.date.available.fl_str_mv 2014-11-14T20:12:52Z
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 FROST, RAY L. et al. Vibrational spectroscopic characterization of the sulphate mineral leightonite K2Ca2Cu(SO4)4 2H2O : implications for the molecular structure. Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy, v. 112, p. 90-94, 2013. Disponível em: <http://www.sciencedirect.com/science/article/pii/S1386142513003545>. Acesso em: 30 set. 2014.
dc.identifier.uri.fl_str_mv http://www.repositorio.ufop.br/handle/123456789/3880
dc.identifier.issn.none.fl_str_mv 1386-1425
dc.identifier.doi.none.fl_str_mv https://doi.org/10.1016/j.saa.2013.04.030
identifier_str_mv FROST, RAY L. et al. Vibrational spectroscopic characterization of the sulphate mineral leightonite K2Ca2Cu(SO4)4 2H2O : implications for the molecular structure. Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy, v. 112, p. 90-94, 2013. Disponível em: <http://www.sciencedirect.com/science/article/pii/S1386142513003545>. Acesso em: 30 set. 2014.
1386-1425
url http://www.repositorio.ufop.br/handle/123456789/3880
https://doi.org/10.1016/j.saa.2013.04.030
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