Importance of the interaction adsorbent–adsorbate in the dyes adsorption process and DFT modeling
IA Aguayo-Villarreal, D Cortes-Arriagada… - Journal of Molecular …, 2020 - Elsevier
The objective of this work is to highlight the importance of the textural and functional groups
present in the carbon surface for the adsorption process of basic, acid and reactive dyes
through experimental and theoretical adsorption studies. The adsorption of dyes on
activated carbon prepared from peach endocarp shell by simple carbonization (CP) and
chemical activation of the precursor by impregnation with CaCl 2 (CPCa) were compared
with theoretical calculations under the DFT framework. The carbonaceous materials were …
present in the carbon surface for the adsorption process of basic, acid and reactive dyes
through experimental and theoretical adsorption studies. The adsorption of dyes on
activated carbon prepared from peach endocarp shell by simple carbonization (CP) and
chemical activation of the precursor by impregnation with CaCl 2 (CPCa) were compared
with theoretical calculations under the DFT framework. The carbonaceous materials were …
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