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    Democratization of University Management for Quality Higher Education
    (Elsevier Science Bv, 2012) Sen, Asim; Kabak, Kamil Erkan; Tuysuz, Fatih; Kuzalic, Dilek
    The objective of this paper is to provide some insights for developing a high quality university through democratizing the contemporary university management practices. The high quality university has often the quality academic programs, quality teaching faculty members, and quality students for establishing high educational standards. The faculty of high quality universities engages in high quality research and produce high quality and quantity of new knowledge and publications. The graduates of high quality universities usually obtain high quality professional positions. They also generate the necessary physical and financial resources and endowments for supporting themselves. Those universities that develop these quality characteristics offer a high quality education. Democratization of the university management practices plays a key role for a university to develop a high quality education and become a high quality university. In this study, democratization process includes the ownership, the practice of sharing the authority and responsibility, group decision-making, horizontal network organizational structure and long term employment practices of university management. Those universities utilizing these practices together and acting collectively as a team are able to achieve a high quality education and become a high quality university. Democratization process will also help stakeholders of the university to establish close cooperation and relations with public and private institutions for financing the university. (C) 2012 Published by Elsevier Ltd. Selection and/or peer-review under responsibility of the 8th International Strategic Management Conference
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    Synthesis, spectroscopic characterization and DFT calculations on N-(Phenylsulfonyl)-L-asparagine (NPLAS): A potential nonlinear optical material
    (Elsevier Gmbh, 2016) Gunay, Nergin; Tamer, Omer; Kuzalic, Dilek; Avci, Davut; Atalay, Yusuf
    The N-(Phenylsulfonyl)-L-asparagine (NPLAS), which is a potential nonlinear optical material, was synthesized and its geometric structure was optimized to obtain its geometric parameters, vibration frequencies and electronic structures at Hartree-Fock (HF) and B3LYP level of density functional theory (DFT) with 6-311 + +G(d,p) basis set, using Gaussian 09W program. The H-1 and C-13 nuclear magnetic resonance (NMR) chemical shifts of the title molecule were calculated by using the gauge independent atomic orbital (GIAO), continuous set of gauge transformations (CSGT) and individual gauges for atoms in molecules (IGAIM) methods and were also compared with experimental values. The electronic properties HOMO and LUMO energies were calculated and analyzed. Potential energy surface scan, natural population analysis (NPA) and Mulliken's atomic charges were also investigated using DFT and HF models. A detailed molecular picture and intermolecular interactions arising from hyperconjugative interactions and charge delocalization of the molecule were analyzed using natural bond orbital (NBO) analysis. (C) 2016 Elsevier GmbH. All rights reserved.
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    Theoretical Investigation of N-Methyl-N '-(4-nitrobenzylidene) pyrazine-2-carbohydrazide: Conformational Study, NBO Analysis, Molecular Structure and NMR Spectra
    (POLISH ACAD SCIENCES INST PHYSICS, 2015) Günay, Nergin; Kuzalic, Dilek
    The crystal structure determination of the methylated pyrazine-2-carbohydrazide derivative, namely Nmethyl-N 0 -(4-nitrobenzylidene)pyrazine-2-carbohydrazide were optimized to obtain its molecular geometric structure and electronic structures at the Hartree Fock and density functional theory levels (B3LYP) with 6-311G(d,p) and 6-311++G(d,p) basis sets, using Gaussian 09W programme. The 1H and 13C nuclear magnetic resonance chemical shifts of the title molecule were calculated by using the gauge independent atomic orbital, continuous set of gauge transformations and individual gauges for atoms in molecules methods and were also compared with experimental values. The electronic properties high occupied and low unoccupied molecular orbitals energies were calculated and analyzed. Potential energy surface scan, natural population analysis and Mulliken atomic charges were investigated using theoretical calculations. A detailed molecular picture and intermolecular interactions arising from hyperconjugative interactions and charge delocalization of the molecule were analyzed using natural bond orbital analysis.