An Alternative Description for the Electronegativity Difference in Binary Ionic Solids

Detalhes bibliográficos
Autor(a) principal: Lima,Heveson
Data de Publicação: 2021
Outros Autores: Ferreira,Douglas, Souza,Adelmo S., Santos,Marcos A. C. dos
Tipo de documento: Artigo
Idioma: eng
Título da fonte: Journal of the Brazilian Chemical Society (Online)
Texto Completo: http://old.scielo.br/scielo.php?script=sci_arttext&pid=S0103-50532021000200405
Resumo: We are introducing an alternative analytical expression to the electronegativity difference (∆χ) as a function of the charge ge, g is the charge factor, the fraction of the electronic charge devoted to the bond and e the elementary charge, the packing factor (p) and the effective atomic number (Zeff) of binary ionic solids, by using the very basic Coulomb interaction, modified by the introduction of p, and the relationship between the electric dipole moment (µ) and ∆χ in Debye units. When compared to the Pauling’s, Gordy’s, Allred-Rochow’s and Allen’s scales, our calculations deviate around 10% to all ionic crystals with such data available in the literature. A very simple expression with satisfactory estimates, with no need of numerical procedure, is announced. The values of g play the important role of indicating the character of the chemical bond. It opens up an alternative opportunity to understand the nature of ionic chemical bonds and is able to describe the character of the bonding in any ionic polyatomic system.
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spelling An Alternative Description for the Electronegativity Difference in Binary Ionic Solidsbinary ionic solidsCoulomb interactioneffective atomic numbercharge transferredchemical bondelectronegativity differenceWe are introducing an alternative analytical expression to the electronegativity difference (∆χ) as a function of the charge ge, g is the charge factor, the fraction of the electronic charge devoted to the bond and e the elementary charge, the packing factor (p) and the effective atomic number (Zeff) of binary ionic solids, by using the very basic Coulomb interaction, modified by the introduction of p, and the relationship between the electric dipole moment (µ) and ∆χ in Debye units. When compared to the Pauling’s, Gordy’s, Allred-Rochow’s and Allen’s scales, our calculations deviate around 10% to all ionic crystals with such data available in the literature. A very simple expression with satisfactory estimates, with no need of numerical procedure, is announced. The values of g play the important role of indicating the character of the chemical bond. It opens up an alternative opportunity to understand the nature of ionic chemical bonds and is able to describe the character of the bonding in any ionic polyatomic system.Sociedade Brasileira de Química2021-02-01info:eu-repo/semantics/articleinfo:eu-repo/semantics/publishedVersiontext/htmlhttp://old.scielo.br/scielo.php?script=sci_arttext&pid=S0103-50532021000200405Journal of the Brazilian Chemical Society v.32 n.2 2021reponame:Journal of the Brazilian Chemical Society (Online)instname:Sociedade Brasileira de Química (SBQ)instacron:SBQ10.21577/0103-5053.20200193info:eu-repo/semantics/openAccessLima,HevesonFerreira,DouglasSouza,Adelmo S.Santos,Marcos A. C. doseng2021-01-28T00:00:00Zoai:scielo:S0103-50532021000200405Revistahttp://jbcs.sbq.org.brONGhttps://old.scielo.br/oai/scielo-oai.php||office@jbcs.sbq.org.br1678-47900103-5053opendoar:2021-01-28T00:00Journal of the Brazilian Chemical Society (Online) - Sociedade Brasileira de Química (SBQ)false
dc.title.none.fl_str_mv An Alternative Description for the Electronegativity Difference in Binary Ionic Solids
title An Alternative Description for the Electronegativity Difference in Binary Ionic Solids
spellingShingle An Alternative Description for the Electronegativity Difference in Binary Ionic Solids
Lima,Heveson
binary ionic solids
Coulomb interaction
effective atomic number
charge transferred
chemical bond
electronegativity difference
title_short An Alternative Description for the Electronegativity Difference in Binary Ionic Solids
title_full An Alternative Description for the Electronegativity Difference in Binary Ionic Solids
title_fullStr An Alternative Description for the Electronegativity Difference in Binary Ionic Solids
title_full_unstemmed An Alternative Description for the Electronegativity Difference in Binary Ionic Solids
title_sort An Alternative Description for the Electronegativity Difference in Binary Ionic Solids
author Lima,Heveson
author_facet Lima,Heveson
Ferreira,Douglas
Souza,Adelmo S.
Santos,Marcos A. C. dos
author_role author
author2 Ferreira,Douglas
Souza,Adelmo S.
Santos,Marcos A. C. dos
author2_role author
author
author
dc.contributor.author.fl_str_mv Lima,Heveson
Ferreira,Douglas
Souza,Adelmo S.
Santos,Marcos A. C. dos
dc.subject.por.fl_str_mv binary ionic solids
Coulomb interaction
effective atomic number
charge transferred
chemical bond
electronegativity difference
topic binary ionic solids
Coulomb interaction
effective atomic number
charge transferred
chemical bond
electronegativity difference
description We are introducing an alternative analytical expression to the electronegativity difference (∆χ) as a function of the charge ge, g is the charge factor, the fraction of the electronic charge devoted to the bond and e the elementary charge, the packing factor (p) and the effective atomic number (Zeff) of binary ionic solids, by using the very basic Coulomb interaction, modified by the introduction of p, and the relationship between the electric dipole moment (µ) and ∆χ in Debye units. When compared to the Pauling’s, Gordy’s, Allred-Rochow’s and Allen’s scales, our calculations deviate around 10% to all ionic crystals with such data available in the literature. A very simple expression with satisfactory estimates, with no need of numerical procedure, is announced. The values of g play the important role of indicating the character of the chemical bond. It opens up an alternative opportunity to understand the nature of ionic chemical bonds and is able to describe the character of the bonding in any ionic polyatomic system.
publishDate 2021
dc.date.none.fl_str_mv 2021-02-01
dc.type.driver.fl_str_mv info:eu-repo/semantics/article
dc.type.status.fl_str_mv info:eu-repo/semantics/publishedVersion
format article
status_str publishedVersion
dc.identifier.uri.fl_str_mv http://old.scielo.br/scielo.php?script=sci_arttext&pid=S0103-50532021000200405
url http://old.scielo.br/scielo.php?script=sci_arttext&pid=S0103-50532021000200405
dc.language.iso.fl_str_mv eng
language eng
dc.relation.none.fl_str_mv 10.21577/0103-5053.20200193
dc.rights.driver.fl_str_mv info:eu-repo/semantics/openAccess
eu_rights_str_mv openAccess
dc.format.none.fl_str_mv text/html
dc.publisher.none.fl_str_mv Sociedade Brasileira de Química
publisher.none.fl_str_mv Sociedade Brasileira de Química
dc.source.none.fl_str_mv Journal of the Brazilian Chemical Society v.32 n.2 2021
reponame:Journal of the Brazilian Chemical Society (Online)
instname:Sociedade Brasileira de Química (SBQ)
instacron:SBQ
instname_str Sociedade Brasileira de Química (SBQ)
instacron_str SBQ
institution SBQ
reponame_str Journal of the Brazilian Chemical Society (Online)
collection Journal of the Brazilian Chemical Society (Online)
repository.name.fl_str_mv Journal of the Brazilian Chemical Society (Online) - Sociedade Brasileira de Química (SBQ)
repository.mail.fl_str_mv ||office@jbcs.sbq.org.br
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