Related papers: Inversion Domain Boundaries in Wurzite GaN
We discuss a simple procedure for computing one-loop quantum energies of any static field configuration that depends non-trivially on only a single spatial coordinate. We specifically focus on domain wall-type field configurations that…
The transport of holes through p-doped wurtzite bulk GaN and AlGaN is poor so transport of holes through GaN/AlGaN superlattices has been proposed and investigated theoretically and experimentally with experimental results showing poor…
We report on the carrier dynamics in InGaN/GaN disk-in-a-wire quantum dots with precisely controlled location and structural parameters, including diameter, thickness and material composition. We measured the time-integrated and…
Domain walls can be formed in superconductors with a discrete degeneracy of the ground state, for instance, due to the breaking of time reversal symmetry. We study all cases where the formation of domain walls is possible in a tetragonal…
We solve the Bogoliubov--de Gennes equations for an inhomogeneous condensate in the vicinity of a linear turning point. A stable integration scheme is developed using a transformation into an adiabatic basis. We identify boundary modes…
We study a simple model supporting domain walls which possess two orientational moduli in addition to the conventional translational modulus. This model is conceptually close to Witten's cosmic strings. We observe an $O(3)$ sigma model on…
Results of the first ab initio simulations of InN/GaN multiquantum well (MQW) system are presented. The DFT results confirm the presence of the polarization charge at InN/GaN interfaces, i.e. at polar InN/GaN heterostructures. These results…
Impurity levels and formation energies of acceptors in wurtzite GaN are predicted ab initio. Be_Ga is found to be the shallow (thermal ionization energy $\sim$ 0.06 eV); $Mg_{Ga}$ and $Zn_{Ga}$ are mid-deep acceptors (0.23 eV and 0.33 eV…
The fusion cross sections from well above barrier to extreme sub-barrier energies have been analysed using the energy (E) and angular momentum (L) dependent barrier penetration model ({\small{ELDBPM}}). From this analysis, the adiabatic…
The ground state structures of the A$_x$B$_{1-x}$C wurtzite (WZ) alloys with $x=$0.25, 0.5, and 0.75 are revealed by a ground state search using the valence-force field model and density-functional theory total energy calculations. It is…
We develop a microscopic approach to the consistent construction of the kinetic theory of dilute weakly ionized gases of hydrogen-like atoms. The approach is based on the framework of the second quantization method in the presence of bound…
The two-dimensional topological insulating phase has been experimentally discovered in HgTe quantum wells (QWs). The low-energy physics of two-dimensional topological insulators (TIs) is described by the Bernevig-Hughes-Zhang (BHZ) model,…
We present a new nonempirical density functional generalized gradient approximation (GGA) that gives significant improvements for lattice constants, crystal structures, and metal surface energies over the most popular Perdew-Burke-Ernzerhof…
Using ab initio methods based on the density functional theory, we investigate the segregation and formation energies for various dopants (Si, Be, Zn, Sn), commonly used to obtain p- or ntype conductivity in GaAs and InAs nanowires. The…
Iron oxides and oxyhydroxides are challenging to model computationally as competing phases may differ in formation energies by only several kJ/mol, they undergo magnetization transitions with temperature, their structures may contain…
Recent developments of the weak turbulence theory applied to internal waves exhibit a power-law solution of the kinetic energy equation close to the oceanic Garrett \& Munk spectrum, confirming weakly nonlinear wave interactions as a likely…
We present in this paper the main structural features and enthalpy details for the energy profiles of the title reactions, both for the exothermic (forward) path to NH$_{3}$ formation and for the endothermic (reverse) reaction to…
The concept of Schramm-Loewner evolution provides a unified description of domain boundaries of many lattice spin systems in two dimensions, possibly even including systems with quenched disorder. Here, we study domain walls in the…
We study the boundary theory of the $\mathbb{Z}_N$ X-cube model using a continuum perspective, from which the exchange statistics of a subset of bulk excitations can be recovered. We discuss various gapped boundary conditions that either…
A model based on the continuous atomic density function (ADF) approach is applied to predict the atomic structure of grain boundaries (GBs) in iron. Symmetrical [100] and [110] tilt GBs in bcc iron are modeled with the ADF method and…