Related papers: Exe.py: Ab initio fine structure parameters for tr…
This work presents a fully theoretical and self consistent framework for calculating the third-order nonlinear susceptibility of CdSe/ZnS--MOF composite quantum dots. The approach unifies finite-potential quantum confinement,the Liouville…
Spin-orbit entangled excitons (SOEE) in two-dimensional (2D) antiferromagnets provide direct access to explore unconventional many body interactions in correlated electron systems. In this work, we carry out a detailed investigation using…
Orbital-free density functional theory (OF-DFT) constitutes a computationally highly effective tool for modeling electronic structures of systems ranging from room-temperature materials to warm dense matter. Its accuracy critically depends…
The High Density Effective Theory formalism is used to calculate the low energy properties of the phonons and gluons in the Larkin-Ovchinnikov-Fulde-Ferrell (LOFF) phase of two-flavor QCD. The effective phonon Lagrangian for the cubic…
The quest for molecular structures exhibiting strong quantum interference effects in the transport setting has long been on the forefront of chemical research. Here, we establish theoretically that the unusual geometry of spiro-conjugated…
Perovskite oxides are already widely used in industry and have huge potential for novel device applications thanks to the rich physical behaviour displayed in these materials. The key to the functional electronic properties exhibited by…
In view of its relation to Big-Bang Nucleo-Synthesis and a reported discrepancy between nuclear models and data taken at S-DALINAC, electro-induced deuteron break-up 2H(e,e' p)n is studied at momentum transfer q<100MeV and close to…
Quantum information processing with neutral atoms relies on Rydberg excitation for entanglement generation. While the use of heavy divalent or open-shell elements, such as strontium or ytterbium, has benefits due to their optically active…
The selective excitation of coherent phonons provides unique capabilities to control fundamental properties of quantum materials on ultrafast time scales. For instance, in the presence of strong electron-phonon coupling, the electronic band…
We analyze fulleride superconductivity at experimental doping levels, treating the electron-electron and electron-phonon interactions on an equal footing, and establish the existence of novel physics which helps explain the unusually high…
We have performed density functional theory (DFT) calculations using the linearized augmented plane wave method (LAPW) with the local density approximation (LDA) functional to study the electronic structure of the iron-based superconductor…
We report on a systematic optical investigation of w\"ustite. In addition, the sample under consideration, Fe0.93O, has been characterized in detail by electrical transport, dielectric, magnetic and thermodynamic measurements. From infrared…
Various classes of exotic singularity models have been studied as possible mimic models for the observed recent acceleration of the universe. Here we further study one of these classes and, under the assumption that they are…
We formulate the effective field theory (EFT) of vector-tensor gravity for perturbations around an arbitrary background with a ${\it timelike}$ vector profile, which can be applied to study black hole perturbations. The vector profile…
Spectral distribution functions of electron-phonon interaction $\alpha^2F(\omega )$ obtained by ab initio linear--response calculations are used to describe various superconducting and transport properties in a number of elemental metals…
Topological entanglement entropy (TEE) is a key diagnostic of long-range entanglement in two-dimensional gapped phases of matter, but it can suffer from spurious contributions that overestimate the total quantum dimension of the underlying…
Generating robust entanglement among solid-state spins is key for applications in quantum information processing and precision sensing. We show here a dissipative approach to generate such entanglement among the hyperfine coupled electron…
We extend our recent work on the cavity-modified spin Zeeman effect of an effective spin-1/2-system[J. Chem. Phys. 163, 174307 (2025)] to a relativistic Jahn-Teller scenario under strong light-matter coupling. Here, the effective…
The phase diagram of half-doped manganite systems of formula A_{0.5}A'_{0.5}MnO_3 is investigated within a single-orbital model incorporating magnetic double-exchange and superexchange, together with intersite Coulomb and electron-lattice…
The discovery of atom-like spin emitters associated with defects in two-dimensional (2D) wide-bandgap (WBG) semiconductors presents new opportunities for highly tunable and versatile qubits. So far, the study of such spin emitters has…