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SEMERCİ, NESLİHAN

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SEMERCİ

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NESLİHAN

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Now showing 1 - 3 of 3
  • Publication
    Modelling the relative toxicity of metals on respiration of nitrifiers using ion characteristics
    (TAYLOR & FRANCIS LTD, 2009) SEMERCİ, NESLİHAN; Sacan, M. T.; Cecen, F.; Erturk, M. D.; Semerci, N.
    The effects of eight transition metals were studied in a nitrifying system to investigate the relationship between the ionic characteristics of metals and their toxicity to nitrifiers. The cumulative oxygen consumption and the cumulative carbon dioxide production were monitored throughout each respirometric batch run to determine the toxicity of metals to nitrifiers. Several quantitative cationic-activity relationship (QCAR) models were developed on the basis of these different toxicity endpoints using quantum chemical descriptors. Descriptors were calculated with density functional theory (DFT) at the B3LYP/LANL2DZ level using the Gaussian 03W software. Additionally, the same descriptors were recalculated using another basis set, B3LYP/SDD, to test the impact of the basis set on prediction of toxicity. Of the calculated descriptors, mainly the gaseous phase descriptors explained significant variances in both toxicity endpoints. However, the energy of the polarized solute-solvent (EPSS) was the most important common descriptors in modelling labile toxicity. A combination of the aqueous phase energy of the highest occupied molecular orbital (EHOMO(aq)) and the maximum value for the energy of the lowest unoccupied molecular orbital of the most important metal species (ELUMOCmax) produced the best two-descriptor model for both pTO2 and pTCO2. The electron donor/acceptor ability of metals and the electron acceptor ability of metal species (ELUMOCmax) seemed to be important in explaining toxicity in aqueous media regardless of the measured endpoints for nitrifiers.
  • Publication
    Importance of cadmium speciation in nitrification inhibition
    (ELSEVIER, 2007) SEMERCİ, NESLİHAN; Semerci, Neslihan; Cecen, Ferhan
    In this study, the influence of Cd speciation on nitrification inhibition was investigated in batch suspended growth activated sludge systems which contain biomass enriched in terms of nitrifiers. For this purpose, parallel measurements of specific oxygen uptake rates (SOUR), ammonium utilization rates (q(NH4)-N) and Cd uptake were carried out. Cd speciation was adjusted with a strong complexing agent, ethylenediaminetetraacetic acid (EDTA). Free and biosorbed Cd concentrations were theoretically determined by using the MINEQL+ program and the Cd adsorption constant, whereas labile Cd was determined by voltammetric measurements. The presence of EDTA decreased nitrification inhibition by lowering the available Cd species and by preventing biosorption of Cd. Almost complete recovery from inhibition was attained by EDTA addition to nitrifying bacteria which were inhibited by Cd for a certain time. These results suggested that the sites sensitive to Cd were rather located on the surface of bacterial cell than inside. Nitrification inhibition depended on equilibrium concentrations of free (Cd2+), labile (Cd-volt) and biosorbed Cd (Cd-volt) and did not correlate with the total Cd. The measurement of labile metal by voltammetry in inhibition studies is a promising approach since it is easy to apply in practice. (C) 2007 Elsevier B.V. All rights reserved.
  • Publication
    Inhibitory effects of Cu, Zn, Ni and Co on nitrification and relevance of speciation
    (WILEY, 2010) SEMERCİ, NESLİHAN; Cecen, Ferhan; Semerci, Neslihan; Geyik, AySe Guel
    BACKGROUND: The speciation of metals is often overlooked in understanding their observed inhibitory effect in biological systems, in particular in nitrification systems. This study examines the effects of Cu, Zn, Ni and Co on a nitrifying sludge, where the aim is to relate inhibition to speciation. RESULTS: Nitrification inhibition was monitored by O-2 and CO2 measurements, an approach rarely followed to date. The IC50 value of each metal was expressed in terms of total, free and labile metal. Zn and Cu formed similar species, but had different free and labile fractions. Although free and labile fractions of Cu were much lower than the others, it was the most inhibitory metal. Ni and Co exhibited quite different inhibitory effects on nitrification despite the formation of similar metal species. Co was the least inhibitory metal and exhibited its effect very slowly. CONCLUSION: The study is among the few which examine inhibition and speciation of several metals in a comparative way. In the same nitrification medium each metal formed different species, which is a factor to be considered in interpretation of inhibition. The results may be projected to nitrifying systems to clarify the underlying factors in inhibition. (C) 2009 Society of Chemical Industry