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To study the role of sulfonate functional groups of humic substances in uranyl(VI) complexation, all‐electron density functional calculations and time‐resolved laser‐induced fluorescence spectroscopy (TRLFS) were applied using small sulfonate ligands as models. A thiolate ligand was explored for comparison. As in an earlier experiment, 4‐hydroxybenzenesulfonic acid (HBSA) and benzenesulfonic acid...
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