Related papers: Microscopic study of the He2-SF6 trimers
A low-field spin flop transition in the quasi one-dimensional antiferromagnet \ba is exploited to study the polarization dependence of low-energy magnetic excitations. The measured longitudinal spectrum is best described as single broad…
The search for elementary excitations with fractional quantum numbers is a central challenge in modern condensed matter physics. We explore the possibility in a realistic model for several materials, the spin-1/2 spatially anisotropic…
A model to describe electronic correlations in energy bands is considered. The model is a generalization of the conventional Hubbard model that allows for the fact that the wavefunction for two electrons occupying the same Wannier orbital…
We investigate the structural, mechanical, and thermoelectric properties of lead-free double halide perovskites Cs2TeX6 (X = Cl, Br, I) using first-principles calculations and semiclassical Boltzmann transport theory. The HSE06 band gap is…
Rashba spin-orbit coupling significantly modifies the electronic band structure in two-dimensional (2D) van der Waals (vdW) heterobilayers, which may enhance their thermoelectric (TE) properties. In this study, we use first-principles…
In this work, we have presented a first principle simulation study on the electronic properties of MoS2/MX2/MoS2 (M=Mo or W; X=S or Se) trilayer heterostrcuture. We have investigated the effect of stacking configuration, bi-axial…
We study the slow decay of the steady-state autocorrelation function $C(t)$ in a stochastic model of deposition and evaporation of trimers on a line with infinitely many conservation laws and sectors. Simulations show that $C(t)$ decays as…
We study the elementary excitations and magnetization of a one-dimensional spin-1/2 XX chain comprising trimer-dimer units (the J1-J1-J2-J3-J2 topology) under a transverse magnetic field h. Using Green's function theory and the…
We calculate accurate potential energy curves for a ground-state He$^+$ ion interacting with a He atom in the lowest-energy metastable $^3\!S$ electronic state. We employ the full configuration interaction method, equivalent to exact…
Ground state of weakly bound dimers and trimers with a radius extending well into the classically forbidden region is explored, with the goal to test the predicted universality of quantum halo states. The focus of the study are molecules…
We study the effects of the uniaxial tensile strain and shear deformation as well as their combinations on the electronic properties of single-layer black phosphorene. The evolutions of the strain-dependent band gap are obtained using the…
Hexagonal SiGe is a promising material for combining electronic and photonic technologies. In this work, the energetic, structural, elastic and electronic properties of the hexagonal polytypes (2$H$, 4$H$ and 6$H$) of silicon and germanium…
When semiconducting transition metal dichalcogenides heterostructures are stacked the twist angle and lattice mismatch leads to a periodic moir\'e potential. As the angle between the layers changes, so do the electronic properties. As the…
Controlling exciton recombination in atomically thin semiconductors is central to their optoelectronic functionality, as the competition between radiative and non-radiative decay channels governs emission efficiency. Existing approaches,…
Cold Helium atoms are a unique system where a single excited three-body Efimov state occurs, naturally, without the need for an external magnetic field. While three-body bound state energies of cold Helium atoms have previously been…
We consider the non-relativistic four-boson system with short-range forces and large scattering length in an effective quantum mechanics approach. We construct the effective interaction potential at leading order in the large scattering…
We have studied the excitation spectrum of the $S=1/2$ quantum spin ladder with staggered dimerization by dimer series expansions, diagrammatic analysis of an effective interacting Bose gas of local triplets, and exact diagonalization of…
The present paper introduces a new multi-reference perturbation approach developed at second order, based on a Jeziorsky-Mokhorst expansion using individual Slater determinants as perturbers. Thanks to this choice of perturbers, an…
We investigate the pairing symmetry of the Kondo-Heisenberg model on triangular lattice, which is believed to capture the core competition of Kondo screening and local magnetic exchange interaction in heavy electron compounds. On the…
Exact results for the dynamic dimer and trimer structure factors of the one-dimensional s=1/2 XX model in a transverse magnetic field ($\parallel z$) are presented and discussed in relation to known exact results for the dynamic spin…