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Toplam kayıt 35, listelenen: 1-10
Tuning the structural, electronic and dynamical properties of Janus M4X3Y3 (M = Pd, Ni and Co; X,Y = S, Se and Te) monolayers: a DFT study
(Royal Soc Chemistry, 2021)
Based on density functional theory, the structural, electronic and vibrational properties of two-dimensional transition metal chalcogenides M2X3 and their Janus type M4X3Y3, where M = Pd, Co and Ni and X = Se, S and Te, ...
Tuning of electronic structure, magnetic phase, and transition temperature in two-dimensional Cr-based Janus MXenes
(Amer Physical Soc, 2021)
Two-dimensional (2D) transition metal carbides and nitrides, called as MXenes, displaying astonishing properties are emerged as a new class of 2D layered materials. In this study, we have studied the structural, electronic, ...
Monte Carlo simulations and forecasting of Radium-226, Thorium-232, and Potassium-40 radioactivity concentrations
(Springer, 2020)
This study depicts the radioactivity time series levels of Ra-226, Th-232, and K-40 prospectively by Monte Carlo simulations (MCSs). Three ARIMA stationary stochastic processes are used with measurement records statistical ...
Oxygen Vacancies in the Single Layer of Ti(2)CO(2)MXene: Effects of Gating Voltage, Mechanical Strain, and Atomic Impurities
(Wiley-V C H Verlag Gmbh, 2020)
Herein, using first-principles calculations the structural and electronic properties of the Ti(2)CO(2)MXene monolayer with and without oxygen vacancies are systematically investigated with different defect concentrations ...
Strain and electric field tuning of semi-metallic character WCrCO2 MXenes with dual narrow band gap
(Iop Publishing Ltd, 2020)
Motivated by the recent successful synthesis of double-M carbides, we investigate structural and electronic properties of WCrC and WCrCO2 monolayers and the effects of biaxial and out-of-plane strain and electric field ...
Structural, electrical and optical characterization of Mn doped CdO photodiodes
(Elsevier, 2020)
Undoped CdO, 0.2% Mn doped CdO, 6% Mn doped CdO and 10% Mn doped CdO photodiodes were prepared using sol-gel method and deposited on Si substrate at room temperature. Electrical and optical properties of the diodes were ...
Facile preparation of commercial Bi2O3 nanoparticle decorated activated carbon for pseudocapacitive supercapacitor applications
(Springer, 2021)
In this work, a facile method to prepare Bi2O3 decorated activated carbon (Bi2O3@AC) composites with high pseudocapacitive properties was presented. The inorganic-organic composites synthesized using commercial Bi2O3 and ...
Analytical eigenstate solutions of Schrodinger equation with noncentral generalized oscillator potential by extended Nikiforov-Uvarov method
(Elsevier, 2021)
Exact eigenstate solutions of Schrodinger equation for a generalized oscillator system that includes, as special cases; ring shaped oscillator potential and isotropic harmonic oscillator potential are examined in an ...
Intriguing of two-dimensional Janus surface-functionalized MXenes: An ab initio calculation
(Elsevier, 2020)
MXenes, two-dimensional (2D) transition metal carbides and nitrides displaying astonishing properties are emerged as a new class of two-dimensional (2D) layered materials. Motivated by the recent successful synthesis of ...
Control of C3N4 and C4N3 carbon nitride nanosheets' electronic and magnetic properties through embedded atoms
(Royal Soc Chemistry, 2020)
In the present work, the effect of various embedded atom impurities on tuning electronic and magnetic properties of C3N4 and C4N3 nanosheets have been studied using first-principles calculations. Our calculations show that ...