Scopus İndeksli Yayınlar Koleksiyonu

Permanent URI for this collectionhttps://hdl.handle.net/20.500.12573/395

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  • Article
    Citation - WoS: 1
    Citation - Scopus: 1
    Liquid and Amorphous States of Boron Subarsenide
    (Wiley, 2019-08-13) Durandurdu, Murat
    Ab initio molecular dynamics simulations are executed to probe the short-range order and the electrical features of the liquid and amorphous boron subarsenide (B12As2). A drastic volume swelling of similar to 40% is witnessed for the liquid state, relative to the crystal. The density of the melt is found to be close to that of liquid boron. As the temperature applied is gradually decreased, the volume progressively decreases and a glass-transition zone at around 1400 K is observed. About 14% volume expansion is perceived for the amorphous phase. Due to the drastic density (volume) difference between the liquid and amorphous forms, their atomic structure is found to be different from each other. In the liquid phase at 2500 K, the mean coordination number (CN) of B and As atoms is 4.4 and 2.5, correspondingly. During the solidification process, both average CNs steadily increase and reach values of 5.5 (B-atom) and 4.14 (As-atom) at 300 K. The pentagonal pyramid-like motifs barely survive at 2500 K but during the quenching process they develop progressively and some of which lead to the formation of B-12 clusters. In the amorphous state, the chain-like and A7-like As-As clusters are observed. Nonetheless, the noncrystalline state is proposed to be partially similar to the crystalline structure. The liquid state shows a metallic character while the amorphous form presents a semiconducting nature having an energy band gap much smaller than that of the crystalline phase.
  • Article
    Citation - WoS: 16
    Citation - Scopus: 16
    Arsenic Removal by the Micellar-Enhanced Ultrafiltration Using Response Surface Methodology
    (Iwa Publishing, 2019-12-27) Gokcek, Oznur Begum; Uzal, Nigmet
    The present research investigates the removal of arsenic (As) from aqueous solutions using micellar-enhanced ultrafiltration (MEUF) by utilizing two different surfactants: benzethonium chloride and dodecyl pyridinium chloride (BCl and DPCl). The impact of the operating variables and maximum removal efficiency were found under different conditions for BCl and DPCl surfactants. The maximum As rejection efficiency for MEUF with BCl and DPCl surfactants is 92.8% and 84.1%, respectively. In addition to this, a statistics-based experimental design with response surface methodology was used for the purpose of examining the impact of operating conditions, including initial pH, initial As concentration (ppb), and surfactant concentration (BCl, mM) in As-removal from aqueous solutions. In the analysis of the experimental data, a second-order polynomial model that was validated by statistical analysis for the BCl surfactant was used. On the basis of the response model created, the removal of As ions was acquired at optimum operating parameters, including the initial As concentration of 150 ppb, surfactant concentration of 5 mM and pH 10 for the BCl surfactant with 92.8% As-removal efficiency.