“…At a discrete level, the electrostatic, non-covalent, and van der Waals interactions play a key role in binding the dye with either free functionalize groups or available Lewis acid/base sites in the cluster. 54 It is a well-known fact that the adsorption is a surface phenomenon, and it largely depends on the structural and functional behavior of the adsorbent, size, and shape of the adsorbate, and surface characteristics of the adsorbent. There are various possible mechanisms reported in the literature for the adsorption process, i.e., acid-base interactions, electrostatic interactions, p-p interactions, hydrogen bonding, and ionexchange mechanism.…”