Surface Complexation Modeling in Variable Charge Soils: Charge Characterization by Potentiometric Titration
ABSTRACT Intrinsic equilibrium constants of 17 representative Brazilian Oxisols were estimated from potentiometric titration measuring the adsorption of H+ and OH− on amphoteric surfaces in suspensions of varying ionic strength. Equilibrium constants were fitted to two surface complexation models: d...
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Sociedade Brasileira de Ciência do Solo
2015-10-01
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doaj-458eb4c2565a431ca6a83f894e7f44572021-01-02T00:35:52ZengSociedade Brasileira de Ciência do SoloRevista Brasileira de Ciência do Solo1806-96572015-10-013951387139410.1590/01000683rbcs20140528S0100-06832015000501387Surface Complexation Modeling in Variable Charge Soils: Charge Characterization by Potentiometric TitrationGiuliano MarchiCesar Crispim VilarGeorge O’ConnorMarx Leandro Naves SilvaABSTRACT Intrinsic equilibrium constants of 17 representative Brazilian Oxisols were estimated from potentiometric titration measuring the adsorption of H+ and OH− on amphoteric surfaces in suspensions of varying ionic strength. Equilibrium constants were fitted to two surface complexation models: diffuse layer and constant capacitance. The former was fitted by calculating total site concentration from curve fitting estimates and pH-extrapolation of the intrinsic equilibrium constants to the PZNPC (hand calculation), considering one and two reactive sites, and by the FITEQL software. The latter was fitted only by FITEQL, with one reactive site. Soil chemical and physical properties were correlated to the intrinsic equilibrium constants. Both surface complexation models satisfactorily fit our experimental data, but for results at low ionic strength, optimization did not converge in FITEQL. Data were incorporated in Visual MINTEQ and they provide a modeling system that can predict protonation-dissociation reactions in the soil surface under changing environmental conditions.http://www.scielo.br/scielo.php?script=sci_arttext&pid=S0100-06832015000501387&lng=en&tlng=enconstantes de equilíbrio intrínsecasLatossolosFITEQLVisual MINTEQprograma de equilíbrio químico |
collection |
DOAJ |
language |
English |
format |
Article |
sources |
DOAJ |
author |
Giuliano Marchi Cesar Crispim Vilar George O’Connor Marx Leandro Naves Silva |
spellingShingle |
Giuliano Marchi Cesar Crispim Vilar George O’Connor Marx Leandro Naves Silva Surface Complexation Modeling in Variable Charge Soils: Charge Characterization by Potentiometric Titration Revista Brasileira de Ciência do Solo constantes de equilíbrio intrínsecas Latossolos FITEQL Visual MINTEQ programa de equilíbrio químico |
author_facet |
Giuliano Marchi Cesar Crispim Vilar George O’Connor Marx Leandro Naves Silva |
author_sort |
Giuliano Marchi |
title |
Surface Complexation Modeling in Variable Charge Soils: Charge Characterization by Potentiometric Titration |
title_short |
Surface Complexation Modeling in Variable Charge Soils: Charge Characterization by Potentiometric Titration |
title_full |
Surface Complexation Modeling in Variable Charge Soils: Charge Characterization by Potentiometric Titration |
title_fullStr |
Surface Complexation Modeling in Variable Charge Soils: Charge Characterization by Potentiometric Titration |
title_full_unstemmed |
Surface Complexation Modeling in Variable Charge Soils: Charge Characterization by Potentiometric Titration |
title_sort |
surface complexation modeling in variable charge soils: charge characterization by potentiometric titration |
publisher |
Sociedade Brasileira de Ciência do Solo |
series |
Revista Brasileira de Ciência do Solo |
issn |
1806-9657 |
publishDate |
2015-10-01 |
description |
ABSTRACT Intrinsic equilibrium constants of 17 representative Brazilian Oxisols were estimated from potentiometric titration measuring the adsorption of H+ and OH− on amphoteric surfaces in suspensions of varying ionic strength. Equilibrium constants were fitted to two surface complexation models: diffuse layer and constant capacitance. The former was fitted by calculating total site concentration from curve fitting estimates and pH-extrapolation of the intrinsic equilibrium constants to the PZNPC (hand calculation), considering one and two reactive sites, and by the FITEQL software. The latter was fitted only by FITEQL, with one reactive site. Soil chemical and physical properties were correlated to the intrinsic equilibrium constants. Both surface complexation models satisfactorily fit our experimental data, but for results at low ionic strength, optimization did not converge in FITEQL. Data were incorporated in Visual MINTEQ and they provide a modeling system that can predict protonation-dissociation reactions in the soil surface under changing environmental conditions. |
topic |
constantes de equilíbrio intrínsecas Latossolos FITEQL Visual MINTEQ programa de equilíbrio químico |
url |
http://www.scielo.br/scielo.php?script=sci_arttext&pid=S0100-06832015000501387&lng=en&tlng=en |
work_keys_str_mv |
AT giulianomarchi surfacecomplexationmodelinginvariablechargesoilschargecharacterizationbypotentiometrictitration AT cesarcrispimvilar surfacecomplexationmodelinginvariablechargesoilschargecharacterizationbypotentiometrictitration AT georgeoconnor surfacecomplexationmodelinginvariablechargesoilschargecharacterizationbypotentiometrictitration AT marxleandronavessilva surfacecomplexationmodelinginvariablechargesoilschargecharacterizationbypotentiometrictitration |
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1724363665569742848 |