info:eu-repo/semantics/article
Covalent bond indices and ionicities from similarity measures
Fecha
2007-07Registro en:
Alcoba, Diego Ricardo; Bochicchio, Roberto Carlos; Lain, Luis; Torre, Alicia; Covalent bond indices and ionicities from similarity measures; Elsevier Science; Chemical Physics Letters; 442; 1-3; 7-2007; 157-163
0009-2614
CONICET Digital
CONICET
Autor
Alcoba, Diego Ricardo
Bochicchio, Roberto Carlos
Lain, Luis
Torre, Alicia
Resumen
This work proposes the use of the mathematical concepts of similarity and distance in metric spaces to relate the covalency and ionicity indices of chemical bondings. Numerical results arising from the Bray-Curtis and divergence measures are reported and discussed in selected molecules. The procedure opens new possibilities to define and to relate complementary quantities.