An Alternative Description for the Electronegativity Difference in Binary Ionic Solids
Autor(a) principal: | |
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Data de Publicação: | 2021 |
Outros Autores: | , , |
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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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 |
_version_ |
1750318183926988800 |