title: Modeling brominated trihalomethane compounds in drinking water at a treatment plant in Beaumont, Texas.
abstract: The premise of this study is that the presence of bromide has a substantial effect on both the speciation and total formation of trihalomethane (THM). Consequently, models of water containing substantial bromide concentrations require refinement because they are only calibrated with raw water with high humic acid content. This study investigates and reports efforts on such refinement. The objectives of work reported in this paper are to formulate and validate a new correlative model that is based on physical principles and incorporates high levels of bromide that affect THM formation using raw water rich in both humic and fulvic acid. Two types of THM precursors are considered in the model discussed in this paper: (1) activated aromatic groups, which are more reactive with chlorine than with bromine, and (2) aliphatic groups, which are more reactive with bromine than with chlorine. Aliphatic and aromatic carbons are incorporated in the model by the inclusion of pertinent variables such as C/N and Br/Cl2 in the algorithm. The model also includes NH4+. This variable affects chlorine consumption that, in turn, potentially affects THM formation. For the first time ever, organic carbon to organic nitrogen and bromide to chlorine ratios is also used as variables potentially affecting THM formation when treating drinking water. The THM model formulated in this paper is an empirical model based on scientific principles and not simply a regression equation. The formulated model is pronounced valid based on a validation effort that employs a portion of an EPA database that was not used for model formulation.
authors.affiliation: Chemical and Environmental Engineering, Illinois Institute of Technology, Chicago, Illinois, USA. chaibn@trinitydc.edu
authors.forename: Embarka
authors.initials: E
authors.lastname: Chaib
authors.forename: Demetrios
authors.initials: D
authors.lastname: Moschandreas
mesh_terms: D001965:Bromides / Q000737:chemistry*; D016208:Databases, Factual; D008956:Models, Chemical; D013781:Texas; D022882:Trihalomethanes / Q000032:analysis* / Q000737:chemistry*; D018508:Water Purification / Q000379:methods* / Q000706:statistics & numerical data; D014881:Water Supply / Q000032:analysis*
chemical_list: D001965:Bromides; D022882:Trihalomethanes