Related papers: Self-compensation in phosphorus-doped CdTe

Fluorite CeO$_2$ doped with group IV elements is studied within the DFT and DFT+U framework. Concentration dependent formation energies are calculated for Ce$_{1-x}$Z$_x$O$_2$ (Z= C, Si, Ge, Sn, Pb, Ti, Zr, Hf) with $0\leq x \leq 0.25$ and…

We present a systematic study of the spin and charge dynamics of copper oxide superconductors as a function of carrier concentration $x$. Our results portray a coherent physical picture, which reveals a quantum critical point at optimum…

Pseudogap in hole-doped cuprate superconductors is acknowledged as a possible key to understanding their ground normal state, however, existing pseudogap models have essential inconsistencies with experiments. In our approach pseudogap…

Density functional theory (DFT) and DFT corrected for on-site Coulomb interactions (DFT+U) calculations are presented on Aluminium doping in bulk TiO$_2$ and the anatase (101) surface. Particular attention is paid to the mobility of oxygen…

We propose a possible scenario for the new metallic conductivity of underdoped and optimally doped cuprates. Charge carriers are assumed to be large polarons which form a Fermi-liquid and Cooper-like pairs below a crossover tempurature…

We theoretically investigate the possibility of establishing ferromagnetism in the topological insulator Bi2Se3 via magnetic doping of 3d transition metal elements. The formation energies, charge states, band structures, and magnetic…

The tuning black phosphorene properties such as structural, electronic, transport are explored via substitutional C-doped. We employed density functional theory (DFT) calculations in combination with non-equilibrium Green's function (NEGF)…

We propose an exotic scenario that topological superconductivity can emerge by doping strongly interacting fermionic systems whose spin degrees of freedom form bosonic symmetry protected topological (SPT) state. Specifically, we study a…

We apply the spin-fermion model to study the normal state and pairing instability in electron-doped cuprates near the antiferromagnetic QCP. Peculiar frequency dependencies of the normal state properties are shown to emerge from the…

The self-organized dopant percolative filamentary model, entirely orbital in character (no fictive spins), explains the evolution with doping of Fermi arcs observed by ARPES, including the previously unexplained abrupt transitions in…

We considered modification of the defect density of states in CdTe as influenced by a buffer layer in ZnO(ZnS, SnSe)/CdS/CdTe solar cells. Compared to the solar cells employing ZnO buffer layers, implementation of ZnSe and ZnS resulted in…

The process of self-compensation in Cd0.95Zn0.05Te:Cl solid-solution crystals has been studied by annealing single crystals under a controlled Cd vapor pressure, with subsequent measurements of the Hall effect, photoluminescence, carrier…

We present results for magnetic excitations in doped copper oxides using the random phase approximation and itinerant electrons. In the [1,0] direction the observed excitations resemble dispersive quasi-particles both in the normal and…

The angle-resolved photoemission spectroscopy (ARPES) autocorrelation in the electron-doped cuprate superconductors is studied based on the kinetic-energy driven superconducting (SC) mechanism. It is shown that the strong electron…

Here we report on fabrication and low temperature magnetotransport measurements of quantum point contacts patterned from a novel two-dimensional electron system - CdTe/CdMgTe modulation doped heterostructure. From the temperature and bias…

We calculate the single-particle Green's function for the tight-binding band structure, $\xi_{\vec p}=-2t\cos p_x-2t\cos p_y -\mu$, with a function of chemical potential $\mu$ for square-lattice system. The form of the single-particle…

Phosphorus (P) in germanium (Ge) delta-doped layers are fabricated in ultra-high vacuum by adsorption of phosphine molecules onto an atomically flat clean Ge(001) surface followed by thermal incorporation of P into the lattice and epitaxial…

We investigate the question whether the unusual doping dependence of the isotope exponent observed in underdoped high-Tc superconductors might be related to another unusual phenomenon observed in these systems: the pseudogap phenomenon.…

We report first-principles microscopic calculations of the formation energy, electrical activity, and magnetic moment of Co dopants and a variety of native defects in TiO2 anatase. Using these results, we use equilibrium thermodynamics to…

Recently, the successful synthesis of the pentagonal form of PdTe$_{2}$ monolayer (\emph{p}-PdTe$_{2}$) was reported [Liu~\emph{et al.}, Nature Materials \textbf{23}, 1339 (2024)]. In this work, we present an extensive first-principles…