Related papers: Periodic Molecular Arrangements from Space Groups
We study a quantum-mechanical system of three particles in a one-dimensional box with two-particle harmonic interactions. The symmetry of the system is described by the point group $D_{3d}$. Group theory greatly facilitates the application…
The spatial symmetry of matter - including finite objects like molecules or atomic clusters, and extended objects like periodic or aperiodic crystals - is described using point groups and space groups. Magnetic point groups and space groups…
We propose a computationally lean, two-stage approach that reliably predicts self-assembly behavior of complex charged molecules on a metallic surfaces under electrochemical conditions. Stage one uses ab initio simulations to provide…
We present a method to detect the unstable periodic orbits of a multidimensional chaotic dynamical system. Our approach allows us to locate in an efficient way the unstable cycles of, in principle, arbitrary length with a high accuracy.…
Two-dimensional colloidal suspensions exposed to periodic external fields exhibit a variety of molecular crystalline phases. There two or more colloids assemble at lattice sites of potential minima to build new structural entities, referred…
We investigate the collapse of three inelastic particles in dimension $d \geq 2$. We obtain general results of convergence and asymptotics concerning the variables of the dynamical system describing a collapsing system of particles. We…
We give a method to determine relative periodic orbits in point vortex systems: it consists mainly into perform a symplectic reduction on a fixed point submanifold in order to obtain a two-dimensional reduced phase space. The method is…
A framework to systematically decouple high order elliptic equations into combination of Poisson-type and Stokes-type equations is developed. The key is to systematically construct the underling commutative diagrams involving the complexes…
We use density functional theory to describe the phase behaviors of rigid molecules. The construction of kernel function G(x, P, x, P) is discussed. Excluded-volume potential is calculated for two types of molecules with C_{2v} symmetry.…
Our previous work on quantum kinematics and coherent states over finite configuration spaces is extended: the configuration space is, as before, the cyclic group Z_n of arbitrary order n=2,3,..., but a larger group - the non-Abelian…
Organizing a chemical space so that elements with similar properties would take neighboring places in a sequence can help to predict new materials. In this paper, we propose a universal method of generating such a one-dimensional sequence…
A method to determine the admissibility of symbolic sequences and to find the unstable periodic orbits corresponding to allowed symbolic sequences for the diamagnetic Kepler problem is proposed by using the ordering of stable and unstable…
Periodic tangles are 1-dimensional submanifolds in the 3-space with translational symmetry. In this paper, we define the linking numbers for singly, doubly, and triply periodic tangles using appropriate motifs and show that they are…
In many areas of applied geometric/numeric computational mathematics, including geo-mapping, computer vision, computer graphics, finite element analysis, medical imaging, geometric design, and solid modeling, one has to compute incidences,…
This paper is concerned with the application of the group SO(4,2)xSU(2) to the periodic table of chemical elements. It is shown how the Madelung rule of the atomic shell model can be used for setting up a periodic table that can be further…
The topology of periodic spaces has attracted a lot of interest in recent years in order to study and classify crystalline structures and other large homogeneous data sets, such as the distribution of galaxies in cosmology. In practice,…
In this paper, a selection of elegant, highly symmetric examples of three-periodic tangled nets and filaments are presented. They are constructed via familiar crystal nets using edges as geometric scaffolds for n-fold helical windings.…
We compute the periods associated with a special class of hyperplane arrangements. In particular, we exhibit a combinatorial condition on the intersection lattice of a hyperplane arrangement that ensures that its associated periods are…
We discuss the basic principles of a self-organization of a finite number of charged particles interacting via the 1/r Coulomb potential in a disk geometry. Our approach is based on the cyclic symmetry and periodicity of the Coulomb…
We first consider the Hamiltonian formulation of $n=3$ systems in general and show that all dynamical systems in ${\mathbb R}^3$ are bi-Hamiltonian. An algorithm is introduced to obtain Poisson structures of a given dynamical system. We…