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Fizik / Physics: Recent submissions
Now showing items 181-200 of 446
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Investigation of the structural, mechanical, dynamical and thermal properties of CsCaF3 and CsCdF3 (IOP PUBLISHING LTD, 2016)The structural, mechanical, dynamical and thermal properties of CsCaF3 and CsCdF3 are presented by using an ab initio pseudopotential method and a linear response scheme, within the generalized gradient approximation. The ...
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(AMERICAN PHYSICAL SOC, 2003)Surface vibrations of diamond C(001)(2 X 1) have been studied by means of electron energy loss spectroscopy as well as first-principles theoretical calculations. Several vibrational modes are newly resolved. Outside the ...
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(AMER INST PHYSICS, 2016)We have employed the ab initio pseudopotential method, within a generalized gradient approximation of the density functional theory, a linear response approach, to determine atomic, elastic and lattice dynamical properties ...
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(SPRINGER, 2016)Structural and optoelectronic properties of the pure l-alanine (CH3CHNH2COOH) and substituted with Li in two different sites CH3CHNHLiCOOH (basic) and CH3CHNH2COOLi (acidic) are systematically investigated by the density ...
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(ELSEVIER SCIENCE SA, 2016)We have carried out an ab initio study of the electronic, vibrational and electron-phonon interaction properties of the body-centred tetragonal CaIrSi3 by employing the density functional theory, a linear-response formalism, ...
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(TAYLOR & FRANCIS LTD, 2016)A novel 1,3,4-oxadiazole-substituted benzo[b]triphenylene was synthesized by three-step synthetic procedure and OFET device design was successfully designed after theoretical calculations made using Gaussian software. For ...
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(TAYLOR & FRANCIS LTD, 2016)We have investigated the electronic structure, phonon modes and electron-phonon coupling to understand superconductivity in the ternary silicide NaAlSi with a layered diamond-like structure. Our electronic results, using ...
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(ELSEVIER SCIENCE BV, 2003)We present structural and dynamical properties of the As covered GaAs(1 1 0) surface based on ab initio density-functional calculations and a linear-response approach. Characteristic phonon modes due to a monolayer deposition ...
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(DE GRUYTER OPEN LTD, 2016)The molecular modeling of p-nitroanilinium perchlorate molecule was carried out by using B3LYP and HSEH1PBE levels of density functional theory (DFT). The IR and Raman spectra were simulated and the assignments of vibrational ...
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(AMER INST PHYSICS, 2016)We have presented theoretical investigations of the atomic, elastic and lattice dynamical properties of ScGa3 using an ab-initio pseudopotential method and a linear response scheme, within the generalized gradient ...
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(SPRINGER, 2015)Occupational fatalities and work-related injuries are more common in Turkey than in most developing and developed countries. Several precautions have been taken concerning the matter, and The Occupational Health and Safety ...
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(ELSEVIER, 2016)The ground state properties namely structural, mechanical, electronic and magnetic properties and thermoelectric behavior of Ru(2)VZ (Z =Si, Ge and Sn) half-metallic ferromagnetic full-Heusler compounds are systematically ...
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(TAYLOR & FRANCIS LTD, 2016)We have performed first-principles method to investigate structural and electronic properties of InNxP1-x ternary semiconductor alloy in full range (0 <= x <= 1) using density functional theory. We have used modified ...
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(SPRINGER/PLENUM PUBLISHERS, 2015)In this work, zinc oxide (ZnO) thin films on quartz substrates were fabricated using the spin-coating method. Thermal annealings from to have been performed in increments and for two annealing durations (0.5 h and 8 h). ...
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(TAYLOR & FRANCIS LTD, 2015)We have made an extensive study of the electronic band structure and phonon spectrum, and the electron-phonon interaction, in BaSn5 by employing an ab initio pseudopotential method and a linear response scheme. The Sn atoms ...
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(NATL INST SCIENCE COMMUNICATION-NISCAIR, 2016)In the present paper, the optical and structural parameters of pure and Dy doped zinc oxide thin films on quartz glass substrate using the dopant of Dy in various doping molar concentrations (0.2 and 0.5 M) with different ...
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(WORLD SCIENTIFIC PUBL CO PTE LTD, 2015)An organic thin film transistor (OTFT) based on pentacene was fabricated with SiO2 as the gate dielectric material. We have investigated the effects of the thickness of pentacene layer and the organic semiconductor (OSC) ...
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(ELSEVIER SCIENCE BV, 2003)Peculiarities of the temperature behaviour of the dielectric susceptibility of TlInS2 in the temperature interval of incommensurate (IC) phase have been theoretically investigated on the basis of recently suggested ...
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Angular and energy distribution for parent primaries of cosmic muons at the sea level using Geant4 (ELSEVIER SCIENCE BV, 2015)The angular and energy distributions of the primary cosmic rays that are responsible for the muons reaching the sea level have been estimated using the Geant4 simulation package. The models used in the simulations were ...
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(AMER PHYSICAL SOC, 2015)Ab initio pseudopotential calculations have been made to calculate the structural, electronic, vibrational, and superconducting properties of the borocarbide superconductors RM2B2C (R = Lu, La, Y; M = Ni,Pd,Pt). Using the ...
Now showing items 181-200 of 446
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