Physics / Fizik
Permanent URI for this collectionhttps://hdl.handle.net/11147/6
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Article Citation - WoS: 2Citation - Scopus: 2Electronic Structure of Cyanocobalamin: Dft+qmc Study(Springer Verlag, 2017) Mayda, Selma; Kandemir, Zafer; Bulut, NejatWe study the electronic structure and the magnetic correlations of cyanocobalamin (C63H88CoN14O14P) by using the framework of the multi-orbital single-impurity Haldane-Anderson model of a transition metal impurity in a semiconductor host. Here, we first determine the parameters of the Anderson Hamiltonian by performing density functional theory (DFT) calculations. Then, we use the quantum Monte Carlo (QMC) technique to obtain the electronic structure and the magnetic correlation functions for this effective model. We find that new electronic states, which correspond to impurity bound states, form above the lowest unoccupied level of the host semiconductor. These new states derive from the atomic orbitals at the cobalt site and the rest of the molecule. We observe that magnetic moments develop at the Co(3dν) orbitals and over the surrounding sites. We also observe that antiferromagnetic correlations exist between the Co (3dν) orbitals and the surrounding atoms. These antiferromagnetic correlations depend on the filling of the impurity bound states.Article Citation - WoS: 2Citation - Scopus: 2Electronic Structure and Correlations of Vitamin B12 Studied Within the Haldane-Anderson Impurity Model(Springer Verlag, 2016) Kandemir, Zafer; Mayda, Selma; Bulut, NejatWe study the electronic structure and correlations of vitamin B12 (cyanocobalamine) by using theframework of the multi-orbital single-impurity Haldane-Anderson model of atransition-metal impurity in a semiconductor host. The parameters of the effectiveHaldane-Anderson model are obtained within the Hartree-Fock (HF) approximation. Thequantum Monte Carlo (QMC) technique is then used to calculate the one-electron andmagnetic correlation functions of this effective model. We observe that new states forminside the semiconductor gap found by HF due to the intra-orbital Coulomb interaction atthe impurity 3d orbitals. In particular, the lowest unoccupiedstates correspond to an impurity bound state, which consists of states from mainly the CNaxial ligand and the corrin ring as well as the Co eg-like orbitals. We alsoobserve that the Co (3d) orbitals can develop antiferromagneticcorrelations with the surrounding atoms depending on the filling of the impurity boundstates. In addition, we make comparisons of the HF+QMC data with the density functionaltheory calculations. We also discuss the photoabsorption spectrum of cyanocobalamine.Article Citation - WoS: 2Citation - Scopus: 2Effect of Al Substitution on Structural and Electrical Properties of Bi1.6pb0.4sr2cacu2-X Mx O8+? Superconducting Ceramics(Springer Verlag, 2013) Bouaicha, F.; Mosbah, M. F.; Hamel, M.; Benmaamar, F.; Amira, A.; Guerfi, T.; Haouam, A.; Özyüzer, LütfiIn this work we study the effect on structural and electrical properties of superconducting compound Bi1.6Pb0.4Sr 2CaCu2-y My O8+δ were M=Al (with y=0-0.6). The samples were prepared by the solid-state reaction method. The samples have been characterized by X-ray diffraction (XRD), scanning electron microscopy (SEM), direct current (DC) resistivity versus temperature ρ(T) and alternative current (AC) susceptibility measurements. Structural analysis shows that the crystalline lattice structure of the prepared sample belongs, mainly, to the superconductive tetragonal phase Bi(Pb)2212. The SEM micrographs show that in the undoped sample the grain size has a random distribution with few grains greater than 5 μm. The grains are very dense and well connected. A quite different microstructure is obtained for the doped samples of which grains are more connected with a flat characteristic shape of Bi(Pb)2212 superconductors. All samples exhibit a superconducting character and Tc and the superconducting volume fraction decrease with increasing rate of aluminum.Article Citation - WoS: 3Citation - Scopus: 3Merger Dynamics in Three-Agent Games(Springer Verlag, 2011) Rador, Tonguç; Derici, R.We present the effect of mergers, a term which we use to mean a temporary alliance, in the dynamics of the three-agent model studied by Ben-Naim, Kahng and Kim and by Rador and Mungan. Mergers are possible in three-agent games because two agents can combine forces against the third player and thus increase their probability to win a competition. We implement mergers in this three-agent model via resolving merger and no-merger units of competition in terms of a two-agent unit. This way one needs only a single parameter which we have called the competitiveness parameter. We have presented an analytical solution in the fully competitive limit. In this limit the score distribution of agents is stratified and self-similar.Article Citation - WoS: 10Citation - Scopus: 11The Effects of Sb Substitution on Structural Properties in Yba 2cu 3o 7 Superconductors(Springer Verlag, 2011) Akyüz, Gönül B.; Kocabaş, Kemal; Yıldız, Aylin; Özyüzer, Lütfi; Çiftçioglu, MuhsinIn this study, the effects of partial Sb 3+ ion substitutions for the Y sites and the Cu sites on the superconducting properties of YBa 2Cu 3O y (Y123) ceramic superconductors were investigated. The samples were prepared by the conventional solid-state reaction method and the properties of the samples were investigated by means of X-ray diffraction, AC magnetic susceptibility measurements, scanning electron microscope, and energy dispersive X-ray analysis. The critical temperatures were determined to be in the range of 80-92 K for both Systems I and II. It was found that Sb-addition leads to the formation of the non-superconducting YBa 2SbO 6 phase, which has a negative effect on the critical temperature, since the highest critical temperature was measured for pure Y123. However, the increasing substitution level has a negligible effect on the X-ray diffraction analysis peak intensities of the superconducting phases. In addition, SEM images showed that Sb substitution decreases the grain size and modifies the microstructure development, which makes the samples denser.Article Citation - WoS: 24Citation - Scopus: 26The Fabrication of Thz Emitting Mesas by Reactive Ion-Beam Etching of Superconducting Bi2212 With Multilayer Masks(Springer Verlag, 2011) Köseoğlu, Hasan; Türkoğlu, Fulya; Şimşek, Yılmaz; Özyüzer, LütfiGeneration of powerful THz radiation from intrinsic Josephson Junctions (IJJs) of Bi2Sr2CaCu2O8+δ (Bi2212) may require mesas with large lateral dimensions. However, there are difficulties in fabrication of perfect rectangular mesas. The lateral angles of mesas should be close to 90 degrees to obtain IJJs with same planar dimensions for synchronization of IJJs. We patterned Ta/photoresist and photoresist/Ta/photoresist masks on Bi2212 and used selectiveionetchingtoovercomethethickphotoresistlayershading on the lateral dimension of mesa during the ion-beam etching. The reactive ion-beam etchings have been done with ion beams of Ar, N2 and O2, and we have obtained mesas about 1 µm with lateral angle of approximately 50 to 75°, which is better than the mesas fabricated with photoresist mask.Article Citation - WoS: 2Citation - Scopus: 2The Icrn Value in Intrinsic Josephson Tunnel Junctions in Bi2sr2cacu2o8+? (bi2212) Mesas(Springer Verlag, 2011) Kurter, Cihan; Özyüzer, Lütfi; Hinks, David G.; Gray, Kenneth E.; Zasadzinski, John F.The c-axis current-voltage I(V) characteristics have been obtained on a set of mesas of varying height sculpted on Bi2Sr2CaCu2O8+δ (Bi2212) crystals intercalated with HgB2. The intercalation, along with the small number of junctions in the mesa, N = 6–30, minimizes the degree of self-heating, leading to a consistent Josephson critical current, IC, among junctions in the mesa. The Bi2212 crystals with a bulk TC =74 K are overdoped and display negligible pseudogap effects allowing an accurate measure of the normal state resistance, RN. These properties make themesas nearlyideal for the determinationof the Josephson ICRN product.Wefind ICRN valuesconsistently ∼30% of the quasiparticle gap parameter, /e, which was measured independently using a mechanical contact, break junction technique. The latter was necessitated by higher bias heating effects in the mesas which prevented direct measurements of the superconducting gap. These values are among the highest reported and may represent the maximum intrinsic value for ICRN. The results indicate that the c-axis transport is a mixture of coherent and incoherent tunneling.Article Citation - WoS: 7Citation - Scopus: 6Hartree-Fock Approximation of Bipolaron State in Quantum Dots and Wires(Springer Verlag, 2010) Senger, Ramazan Tuğrul; Kozal, B.; Chatterjee, A.; Erçelebi, AtillaThe bipolaronic ground state of two electrons in a spherical quantum dot or a quantum wire with parabolic boundaries is studied in the strong electron-phonon coupling regime. We introduce a variational wave function that can conveniently conform to represent alternative ground state configurations of the two electrons, namely, the bipolaronic bound state, the state of two individual polarons, and two nearby interacting polarons confined by the external potential. In the bipolaron state the electrons are found to be separated by a finite distance about a polaron size. We present the formation and stability criteria of bipolaronic phase in confined media. It is shown that the quantum dot confinement extends the domain of stability of the bipolaronic bound state of two electrons as compared to the bulk geometry, whereas the quantum wire geometry aggravates the formation of stable bipolarons. © 2010 EDP Sciences, SIF, Springer-Verlag Berlin Heidelberg.Article Citation - WoS: 21Citation - Scopus: 22Vacuum Energy as the Origin of the Gravitational Constant(Springer Verlag, 2009) Demir, Durmuş AliWe develop a geometro-dynamical approach to the cosmological constant problem (CCP) by invoking a geometry induced by the energy-momentum tensor of vacuum, matter and radiation. The construction, which utilizes the dual role of the metric tensor that it structures both the spacetime manifold and energy-momentum tensor of the vacuum, gives rise to a framework in which the vacuum energy induced by matter and radiation, instead of gravitating, facilitates the generation of the gravitational constant. The non-vacuum sources comprising matter and radiation gravitate normally. At the level of classical gravitation, the mechanism deadens the CCP yet quantum gravitational effects, if strong, can keep it existent.Article Citation - WoS: 89Citation - Scopus: 94Effects of Li Substitution in Bi-2223 Superconductors(Springer Verlag, 2008) Bilgili, Özlem; Selamet, Yusuf; Kocabaş, KemalThe effects of Li substitution on the properties of high temperature superconductor Bi 17Pb 0.3Sr 2C 2Cu 3-x Li x O y were investigated. The samples were prepared by substituting Li (x=0.00-0.20) with changing ratios by a solid state reaction method. The samples were characterized by X-ray diffraction, DC electrical resistivity, AC magnetic susceptibility, and scanning electronic microscopy (SEM). The X-ray diffraction studies were done at room temperature and the lattice constants of the material were determined by indexing all the peaks observed. This study shows that there are two coexisting phases; high-T c (2223) phase and low-T c (2212) phase. The lattice structure of the material belongs to the orthorhombic unit cell. The volume fraction was estimated from the intensities of Bi-(2223) and Bi-(2212) phases. The sample with 20 wt% of added Li showed the higher volume fraction of Bi-(2223) phase formed (81%) compared to the other samples. The DC electrical resistivity of all the samples decreased as the wt% of Li increased. Both the onset critical temperatures T c (onset) and zero electrical resistivity critical temperatures T c (R=0) of the samples were determined from the DC electrical resistivity measurements. The observed value of the onset critical T c (onset) temperature was 110 K agreeing well with the magnetic susceptibility measurements. We obtained T c onset at 112 K from AC magnetic susceptibility measurements. © 2008 Springer Science+Business Media, LLC.