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Role of Functional Groups in Selective Adsorption of Gold over Copper Cyano complexes by Activated Carbon: A DFT Study

Sina Ghasemi; Sima Mohammadnejad; Mohammad Reza Khalesi

Volume 13, Issue 3 , July 2022, , Pages 891-901

https://doi.org/10.22044/jme.2022.12125.2210

Abstract
  The adsorption of gold and copper cyanide complexes on the activated carbon is investigated using the Density Functional Theory (DFT). In order to represent the activated carbon, two fullerene-like model (presenting structural defect sites) and a simple graphene layer containing different functional ...  Read More