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Toplam kayıt 1279, listelenen: 71-80
Structure of trimers of group-2B metal dihalides from relativistic density-functional calculations
(Taylor & Francis Ltd, 2015)
We report density-functional calculations, carried out in a quantum-chemical approach using localised-Gaussians expansions of the Kohn-Sham orbitals, for metal dihalides trimers (MX2)(3), where X=Cl, Br, or I and M=Zn, Cd, ...
The origins of tetrahedral coordination in molten and glassy ZnCl2 and other group-2B metal dihalides
(Elsevier, 2014)
We report the results of first-principles calculations carried out within a relativistic density-functional method, on the molecular trimers of the MX2 compounds (with M = Zn or Cd and X = Cl, Br, or I), showing how a ...
Simulation of pandemics in real cities: enhanced and accurate digital laboratories
(Royal Soc, 2021)
This study develops a modelling framework for simulating the spread of infectious diseases within real cities. Digital copies of Birmingham (UK) and Bogota (Colombia) are generated, reproducing their urban environment, ...
Investigation of Wave Characteristics in Oscillatory Motion of Partially Filled Rectangular Tanks
(Asme, 2018)
Simulations of oscillatory motion in partially filled rectangular tanks with different tank geometries, fullness ratios, and motion frequencies are presented. Smoothed particle hydrodynamics (SPH) method is used to discretize ...
The Effect of Iterative Procedures on the Robustness and Fidelity of Augmented Lagrangian SPH
(Mdpi, 2021)
The Augmented Lagrangian Smoothed Particle Hydrodynamics (ALSPH) method is a novel incompressible Smoothed Particle Hydrodynamics (SPH) approach that solves Navier-Stokes equations by an iterative augmented Lagrangian ...
A spectral domain integral equation technique for rough surface scattering problems
(Taylor & Francis Ltd, 2019)
In this paper, a novel formulation for scattering from one-dimensional (1D) rough surface problem has been presented. The formulation is based on the representation of the scattering field in spectral domain with an unknown ...
Weighted approximation by q-Ibragimov-Gadjiev operators
(Univ Osijek, Dept Mathematics, 2020)
The present paper deals with a q-generalization of Ibragimov-Gadjiev operators, which were constructed by Ibragimov and Gadjiev in 1970. We study convergence properties on the interval [0, infinity) and obtain the rate of ...
Fluorescence Study of Film Formation from PS Latex-TiO2 Composites: Effects of TiO2 Content, Film Thickness and Particle Size
(Amer Scientific Publishers, 2015)
Steady-state fluorescence (SSF) technique in conjunction with UV-visible (UVV) technique, atomic force microscope (AFM) and scanning electron microscope (SEM) is used for studying film formation from TiO2 covered polystyrene ...
Study of Film Formation From PS Latex/TiO2 Nanocomposites; Effect of Latex Size and TiO2 Content
(Wiley, 2014)
In this work, we investigated the film formation from polystyrene (PS) latex/TiO2 nanocomposites using the steady state fluorescence (SSF) and UV-vis (UVV) techniques depending on PS particle size and TiO2 content. The ...
Theoretical insight of alpha amino acid phenylalanine adsorption on pristine and decorated fullerenes
(Walter De Gruyter Gmbh, 2019)
Fullerenes, with their extensive application potentials, have been receiving attention for their possible usage as drug delivery vehicles and devices for sensor technologies. In this work, the optimized molecular geometries, ...