Related papers: Orthogonal and Non-Orthogonal Tight Binding parame…
In this paper, we study the impact of using III-nitride semiconductors (GaN, AlN) as substrates for ultrathin (11 nm) superconducting films of NbTiN deposited by reactive magnetron sputtering. The resulting NbTiN layers are (111)-oriented,…
We generalize solid-state tight-binding techniques for the spectral analysis of large superconducting circuits. We find that tight-binding states can be better suited for approximating the low-energy excitations than charge-basis states, as…
A simulation framework that couples atomistic electronic structures to Boltzmann transport formalism is developed and applied to calculate the transport characteristics of thin silicon nanowires (NWs) up to 12nm in diameter. The…
We present a computationally efficient transferable single-band tight-binding model (SBTB) for spin polarized transport in heterostructures with an effort to capture the band structure effects. As an example, we apply it to study transport…
We study non-interacting electrons in disordered materials which exhibit a spectral gap, in each of the ten Altland--Zirnbauer symmetry classes, in all space dimensions. We define an appropriate space of Hamiltonians and a topology on it so…
It is critical to capture the effect due to strain and material interface for device level transistor modeling. We introduced a transferable sp3d5s* tight binding model with nearest neighbor interactions for arbitrarily strained group IV…
In the empirical tight-binding approach we study the electronic states in spherical SiGe nanocrystals embedded in SiO2 matrix. The energy and valley structure is obtained as a function of Ge composition and nanocrystal size. The…
In a recent Letter [PRL, 107, 047208 (2011)], Zorko et al. report on an "unexpected inhomogeneous magnetism" related to "a peculiar fragility" of the resonating-valence-bond (RVB) electronic state in the spin-1/2 quantum magnet CuNCN. Here,…
We investigate non-linear transport signatures stemming from linear and cubic spin-orbit interactions in one- and two-dimensional systems. The analytical zero-temperature response to external fields is complemented by finite temperature…
We investigate electron correlation effects in stoichiometric Titanium Nitride (TiN) using a combination of electronic structure and many-body calculations. In a first step, the Nth-order muffin tin orbital technique is used to obtain…
Nb-based circuits have broad applications in quantum-limited photon detectors, low-noise parametric amplifiers, superconducting digital logic circuits, and low-loss circuits for quantum computing. The current state-of-the-art approach for…
InN quantum dots (QDs) are considered to be promising nanostructures for different device applications. For any hexagonal AB stacking semiconductor system, polarity is an important feature which affects the electronic properties. Therefore,…
When certain elemental metals like Cu, Sr and Nb are intercalated between the layers of Bi$_2$Se$_3$, a topological insulator, the intercalated systems superconduct with critical temperatures around 3 K. Naturally, in all these cases, the…
One of the most used approaches in simulating materials is the tight-binding approximation. When using this method in a material simulation, it is necessary to compute the eigenvalues and eigenvectors of the Hamiltonian describing the…
In this paper we employ a combined {\it ab initio} and tight-binding approach to obtain the electronic and optical properties of hydrogenated InN nanowires. We first discuss InN band structure for the wurtzite structure calculated at the…
Topological phases associated with non-Abelian charges can exhibit a distinguished bulk-edge correspondence compared with Abelian phases, although elucidating this relationship remains challenging in traditional solid-state systems. In this…
The projection of the eigenfunctions obtained in standard plane-wave first-principle electronic-structure calculations into atomic-orbital basis sets is proposed as a formal and practical link between the methods based on plane waves and…
This paper presents the fabrication and characterization of superconducting qubit components from titanium nitride (TiN) and aluminum nitride (AlN) layers to create Josephson junctions and superconducting resonators in an all-nitride…
Using highly efficient GPU-based simulations of the tight-binding Bogoliubov-de Gennes equations we solve self-consistently for the pair correlation in rhombohedral (ABC) and Bernal (ABA) multilayer graphene by considering a finite…
The nested off-diagonal Bethe ansatz method is proposed to diagonalize multi-component integrable models with generic integrable boundaries. As an example, the exact solutions of the su(n)-invariant spin chain model with both periodic and…