A density functional theory study of arsenic immobilization by the Al(III)-modified zeolite clinoptilolite
Version 2 2024-06-13, 14:33Version 2 2024-06-13, 14:33
Version 1 2021-06-28, 08:13Version 1 2021-06-28, 08:13
journal contribution
posted on 2024-06-13, 14:33authored byJoel B Awuah, Nelson Y Dzade, Richard Tia, Evans Adei, Bright Kwakye-Awuah, C Richard A Catlow, Nora H de Leeuw
We present density functional theory calculations of the adsorption of arsenic acid (AsO(OH)3) and arsenous acid (As(OH)3) on the Al(iii)-modified natural zeolite clinoptilolite under anhydrous and hydrated conditions.