نتایج جستجو برای: electronic density distribution
تعداد نتایج: 1173593 فیلتر نتایج به سال:
we inverse the surface gravity data to recover subsurface 3d density distribution with two strategy. in the first strategy, we assumed wide density model bound for inverting gravity data and in the second strategy, the inversion procedure have been carried out by limited bound density. wediscretize the earth model into rectangular cells of constant andunidentified density. the number of cells i...
The anomalous resonant behavior of the tangential Raman modes of carbon nanotubes has been studied in the critical region of laser energies 1.7–2.2 eV. The special enhancement of the Raman modes is explained by a model that takes into account the transition between the singularities in the one-dimensional density of electronic states for the metallic nanotubes and the distribution of diameters ...
In this paper, we study the electronic conductance and density of states for a comb-like polymer with periodic hopping energies in the tight-binding approach. Electron transmission coefficient and density of states are analytically calculated by using Green’s function of the system. The results show that the electronic conductance spectrum has one energy gap in the absence of carbon-hydrogen b...
The high pressure behavior of the structural and electronic properties of KC1 is studied with use of the density functional pseudopotential method within local-density approximation. Atzero pressure, the rocksalt phase is found to be lower in energy than CsCl structure. However, we predict a phase transition into CsCI structure at a pressure of about 1.5 GPa. The calculated ground state pro...
Organic-inorganic lead halide perovskites are distinct from most other semiconductors because they exhibit characteristics of both electronic and ionic motion. Accurate understanding of the optoelectronic impact of such properties is important to fully optimize devices and be aware of any limitations of perovskite solar cells and broader optoelectronic devices. Here we use a numerical drift-dif...
The electronic charge density distribution or the electrostatic atomic potential of a solid or molecule contains information not only on the atomic structure, but also on the electronic properties, such as the nature of the chemical bonds or the degree of ionization of atoms. However, the redistribution of charge due to chemical bonding is small compared with the total charge density, and there...
to estimate population density of the cabbage aphid, brevicoryne brassicae (l.), a stratified random sampling was conducted in two unsprayed canola fields in isfahan (central iran) during 2011-2012. population density was determined for apterous, and alates, as well as the total population, at two plant growth phases (pgp1: from plant emergence to the end of rosette, and pgp2: from the beginnin...
The impact of cation distribution on electronic structure and magnetic properties is investigated by the first-principle calculation. The structure optimization is based on generalized gradient approximation GGA exchange-correlation and projector augmented wave method. The optimized structures of inverse and normal copper ferrite are tetragonal c /a=1.06 and cubic, respectively. The optimized s...
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