Related papers: Intrinsic point defects in aluminum antimonide
We study the formation energies of native point defects in GaN through density-functional theory. In our first-principles scheme, the band edges are positioned in accord with hybrid density functional calculations, thus yielding a band-gap…
The first--principles density functional molecular dynamics simulations have been carried out to investigate the geometric, the electronic, and the finite temperature properties of pure Li clusters (Li$_{10}$, Li$_{12}$) and Al--doped Li…
The first principles calculations of band gaps and bulk moduli of cesium lead halide perovskite solid solutions, $CsPb(I_{1-x}Cl_x)_3$ and $CsPb(I_{1-x}Br_x)_3$, are performed at the level of general gradient approximation of the density…
Using the AdS/CFT correspondence, we probe the extremal black holes by studying the energy loss of a moving heavy point particle in a strongly-coupled boundary field theory at zero temperature and finite charge density. We first consider…
We have performed accurate \emph{ab--initio} pseudopotential calculations for the structural and electronic properties of ZnSe/GaAs(001) heterostructures with interface configurations accounting for charge neutrality prescriptions. Beside…
I calculated the effect of magnetic impurities on the normal and superconductive properties of a multiband s-wave superconductor by direct solution of the two-band Eliashberg equations. In this way I determined the critical temperature, the…
We have investigated the influence of point defect disorder in the electronic properties of manganite films. Real-time mapping of ion irradiated samples conductivity was performed though conductive atomic force microscopy (CAFM). CAFM…
CdTe and its alloy CdTeSe are widely used in optoelectronic devices, such as radiation detectors and solar cells, due to their superior electrical properties. However, the formation of defects and defect complexes in these materials can…
In the present Ph.D. Thesis we report an experimental investigation on the effects of gamma- and beta-ray irradiation and of subsequent thermal treatment on many types of a-SiO2 materials, differing in the production methods, OH- and…
An exact relation between the conductance maximum $G_0$ at zero temperature and a ratio of lead densities is derived within the framework of the single impurity Anderson model: $G_0={\mathfrak R}[n] \frac{2e^2}{h}$, where ${\mathfrak…
The structural, electronic, dielectric and vibrational properties of zinc-blende (ZB) InAs were studied within the framework of density functional theory (DFT) by employing local density approximation and norm-conserving pseudopotentials.…
This is a short review of recent developments in the application of AdS/CFT methods to some condensed matter problems. In particular we present the holographic description of a local quantum critical state, related to (non)-Fermi liquids…
Impurities are ubiquitous in condensed matter. Boundary Conformal Field Theory (BCFT) provides a powerful method to study a localized quantum impurity interacting with a gapless continuum of excitations. The results can also be implied to…
It is now widely recognized that surface and interfacial defects exhibit distinct behavior compared to bulk defects in metal halide perovskites. However, the transition from bulk to surface behavior and the spatial extent of the surface's…
We apply high resolution scanning tunneling microscopy to study intrinsic defect states of bulk FeSe. Four types of intrinsic defects including the type I dumbbell, type II dumbbell, top-layer Se vacancy and inner-layer Se-site defect are…
We present a theoretical description of the differential conductance of point contacts between a normal metal and a multi-band superconductor with extended s\pm pairing symmetry. We demonstrate that the interband impurity scattering…
We report the first ever accurate theoretical prediction of thermal conductance of any material interface. Thermal interfacial conductance of aluminum (Al)-sapphire ({\alpha}-Al2O3) interface along crystal directions (111) Al || (0001)…
We derive and analyze the longitudinal and the anomalous Hall conductivity for a general momentum-block-diagonal two-band model. This model captures a broad spectrum of physically very different systems including N\'eel antiferromagnetic…
Measurements of the local density of states near impurities can be useful for identifying the superconducting gap structure in alkali doped iron chalcogenide superconductors K_xFe_{2-y}Se_2. Here, we study the effects of nonmagnetic and…
We calculate exactly the vacuum polarization charge density in the field of a subcritical Coulomb impurity, $Z|e|/r$, in graphene. Our analysis is based on the exact electron Green's function, obtained by using the operator method, and…