Related papers: Crystallization in the hexagonal lattice for ionic…
We consider the Schr\"odinger-Poisson-Newton equations for finite crystals under periodic boundary conditions with one ion per cell of a lattice. The electrons are described by one-particle Schr\"odinger equation. Our main results are i)…
Let $L =\sqrt{\frac{1}{\Im(z)}}\Big({\mathbb Z}\oplus z{\mathbb Z}\Big)$ where $z \in \mathbb{H}=\{z= x+ i y\;\hbox{or}\;(x,y)\in\mathbb{C}: y>0\}$ be the two dimensional lattices with unit density. Assuming that $\alpha\geq1$, we prove…
Structural and static properties of a classical two-dimensional (2D) system consisting of a finite number of charged particles which are laterally confined by a parabolic potential are investigated by Monte Carlo (MC) simulations and the…
In this paper we extend the classical method of lattice dynamics to defective crystals with partial symmetries. We start by a nominal defect configuration and first relax it statically. Having the static equilibrium configuration, we use a…
Evaluation of internal energy and the inter-atomic or ionic interactions in a crystal lattice usually requires precise calculation of lattice sums. This in the case of small nano-particles (as space-limited domains) presents several…
We study resonant optical excitations of atoms in a one-dimensional lattice to the Rydberg states interacting via the van der Waals potential which suppresses simultaneous excitation of neighboring atoms. Considering two- and three-level…
Coulomb plasmas crystallize in a number of physical systems, such as dusty plasmas, neutron star crusts, and white dwarf cores. The crystal structure of the one component and binary plasma has received significant attention in the…
We investigate the emergence of rigid polycrystalline structures from atomistic particle systems. The atomic interaction is governed by a suitably normalized pair interaction energy, where the `sticky disk' interaction potential models the…
The spin-$1$ orthogonal dimer chain is investigated using the Density Matrix Renormalization Group (DMRG) algorithm. A transformation to a basis that uses the local eigenstates of the orthogonal dimers, while retaining the local spin states…
A space-periodic ground state is shown to exist for lattices of point ions in $\R^3$ coupled to the Schr\"odinger and scalar fields. The coupling requires the renormalization of the selfaction because of the singularity of the Coulomb…
We study the atomistic-to-continuum limit of a class of energy functionals for crystalline materials via Gamma-convergence. We consider energy densities that may depend on interactions between all points of the lattice and we give…
We consider $\mathbb{S}^2$-valued maps on a domain $\Omega\subset\mathbb{R}^N$ minimizing a perturbation of the Dirichlet energy with vertical penalization in $\Omega$ and horizontal penalization on $\partial\Omega$. We first show the…
Using a straightforward extension of the analysis of Lieb and Wu, we derive a simple analytic form for the ground state energy of a one-dimensional Hubbard ring in the atomic limit. This result is valid for an \textit{arbitrary} number of…
The spin-one-half Falicov-Kimball model with spin-dependent on-site interaction between localized ($f$) and itinerant ($d$) electrons is studied by small-cluster exact-diagonalization calculations and a well-controlled approximative method…
Equilibration of a one-dimensional system of interacting electrons requires processes that change the numbers of left- and right-moving particles. At low temperatures such processes are strongly suppressed, resulting in slow relaxation…
We analyze the eigenstates of a two-dimensional lattice with additional harmonic confinement in the presence of an artificial magnetic field. While the softness of the confinement makes a distinction between bulk and edge states difficult,…
Almost all the polymer crystals have several polymorphic modifications. Their structure and existence conditions, as well as transitions between them are not understood even in the case of the 'model' polymer polyethylene (PE). For analysis…
We have successfully synthesized single crystals, solved the crystal structure, and studied the magnetic properties of a new family of copper halides (C$_4$H$_{14}$N$_2$)Cu$_2X_6$ ($X$= Cl, Br). These compounds crystallize in an…
We establish dimerization in $O(n)$-invariant quantum spin chains with big enough $n$, in a large part of the phase diagram where this result is expected. This includes identifying two distinct ground states which are translations of one…
We analyse an energy minimisation problem recently proposed for modelling smectic-A liquid crystals. The optimality conditions give a coupled nonlinear system of partial differential equations, with a second-order equation for the…