Browsing Yayın Koleksiyonu by Publisher "Elsevier B.V."
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Comparison of pure and mixed gas permeation of the highly fluorinated polymer of intrinsic microporosity PIM-2 under dry and humid conditions: Experiment and modelling
(Elsevier B.V., 2020)This manuscript describes the gas separation performance of PIM-2, a partially fluorinated linear copolymer synthesized from 5,5',6,6'-tetrahydroxy-3,3,3',3'-tetramethylspirobisindane (TTSBI) and decafluorobiphenyl (DFBP). ... -
Comparison of the effects of Sr2+ and Ca2+ substitution on the structural and electronic properties of the perovskites CH3NH3Pb1-xYxI3 (Y[dbnd]Sr, Ca) by using the Density Functional Theory
(Elsevier B.V., 2021)The Vienna ab-initio simulation package (VASP) and Density Functional Theory (DFT) calculation method are used to study the structural and detailed electronic properties through atomic substitution in the CH3NH3Pb(1-x)Y(x)I3 ... -
Experimental and Theoretical Vibrational Spectroscopic Investigations, DFT quantum chemical analysis, Biological activities and Molecular docking on 4,4′-Dimethoxy-2,2′-Bipyridine
(Elsevier B.V., 2022)The present study describes the torsional potentials, molecular geometry in monomer and dimer forms of purchased 4,4′-dimethoxy-2,2′-bipyridine (Dmobpy). The results of experimental Fourier Transform In- frared (FT-IR) ... -
First-principles study for comparison of the electronic and optic bandgaps of the CH3NH3Pb1-xYxI3 (Y=Bi, x=0.00, 0.125) and CH3NH3Pb1-xYxI3 (Y=Ca, Sr, x=0.125, 0.250) perovskites
(Elsevier B.V., 2021)We computed the optical bandgaps of the CH3NH3Pb(1-x)Y(x)I3 (Y=Bi, x = 0.00, 0.125) and CH3NH3Pb(1-x)Y(x)I3 (Y=Ca, Sr, x = 0.125, 0.250) perovskite crystal structures using optical arguments such as the imaginary part of ... -
Metal-free N-doped ultrafine carbon fibers from electrospun Polymers of Intrinsic Microporosity (PIM-1) based fibers for oxygen reduction reaction
(Elsevier B.V., 2020)Synthesis of nitrogen-doped carbon fibers (CF) has been proved to be one of the most promising oxygen reduction reaction (ORR) catalysts which can replace the state-of-art Pt catalyst for non-noble metal-free light-weight ... -
Synthesis, characterization, biological, X-ray diffraction analysis and computational chemistry studies of new 2-acetylpyridine derivative hydrazone and its Zn(II) complex
(Elsevier B.V., 2020)A new aroyl hydrazone ligand ((E)-2-phenyl-N’-(1-(pyridine-2-yl)ethylidene)acetohydrazide) HL and its metal complex [ZnL2] (1) have been synthesized and characterized by using elemental analysis, IR and UV–vis spectroscopy ... -
Synthesis, structural characterization and X-ray analysis of (E)-N'-((2-hydroxynaphthalen-1-yl)methylene)-4-ethylbenzenesulfonohydrazide and Its Ni(II) complex
(Elsevier B.V., 2022)A new p-toluene sulfonyl hydrazide derivative sulfonyl hydrazone and its Ni(II) complex have been synthesized. The ligand (E)-N'-((2-hydroxynaphthalen-1-yl)methylene)-4-ethylbenzenesulfonohydrazide (HL) was characterized ...