Related papers: Core repulsion effects in alkali trimers
Recent observations of destructive quantum interference in single-molecule junctions confirm the role played by quantum effects in the electronic conductance properties of molecular systems. We show here that the destructive interference…
The problem of three interacting Kondo impurities is solved within a numerically exact continuous time quantum Monte Carlo scheme. A suppression of the Kondo resonance by interatomic exchange interactions for different cluster geometries is…
Aiming to approach the thermodynamical properties of hard-core systems by standard molecular dynamics simulation, we propose setting a repulsive constant-force for overlapping particles. That is, the discontinuity of the pair potential is…
The He2-SF6 trimers, in their different He isotopic combinations, are studied both in the framework of the correlated Jastrow approach and of the Correlated Hyperspherical Harmonics expansion method. The energetics and structure of the…
The strong short-range repulsion, characteristic to realistic interatomic potentials, complicates the description of weakly-bound few-body systems such as those of \He atoms. The present work proposes an approach for solving this problem…
An Efimov trimer near the atom-dimer threshold can increase the atom loss rate in ultracold trapped atoms through the {\it avalanche mechanism} proposed by Zaccanti et al. A 3-body recombination event creates an energetic atom and dimer,…
The electron removal and excitation channels in argon dimer target and helium ion projectile collision systems that facilitate interatomic Coulombic decay (ICD) are investigated. We implement an independent-atom and independent-electron…
Receptors of bacterial chemotaxis form clusters at the cell poles, where clusters act as "antennas" to amplify small changes in ligand concentration. Interestingly, chemoreceptors cluster at multiple length scales. At the smallest scale,…
We present a study on ion-atom-atom reaction A+A+B$^+$ in a wide range of systems and collision energies ranging from 100$~\mu$K to 10$^5~$K, analyzing the two possible products: molecules and molecular ions. The dynamics is performed via a…
The Efimov (Thomas) trimers in excited 12 C nuclei, for which no observation exists yet, are discussed by means of analyzing the experimental data of 70(64) Zn( 64 Ni) + 70(64) Zn( 64 Ni) reactions at beam energy of E/A=35MeV/nucleon. In…
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 use Molecular Dynamics simulations to study attractive interactions and the underlying ionic correlations between parallel like-charged rods in the absence of additional salt. For a generic bulk system of rods we identify a reduction of…
Studying chemical reactions at very low temperatures is of importance for the understanding of fundamental physical and chemical processes. At very low energies, collisions are dominated by only a few partial waves. Thus, studies in this…
Over the past decade, tremendous progress has been made to extend the tools of laser cooling and trapping to molecules. Those same tools have recently been applied to polyatomic molecules (molecules containing three or more atoms). In this…
Molecular dynamics simulations have been used extensively to determine equilibrium properties of the electrode-electrolyte interface in supercapacitors held at various potentials. While such studies are essential to understand and optimize…
The insulating mixed-valent Ir$^{+3.66}$ compound Ba$_4$NbIr$_3$O$_{12}$ hosts two holes per Ir$_3$O$_{12}$ trimer unit. We address the electronic structure via resonant inelastic x-ray scattering (RIXS) at the Ir $L_3$ edge and exact…
In this work we investigate small clusters of helium atoms using the hyperspherical harmonic basis. We consider systems with $A=2,3,4,5,6$ atoms with an inter-particle potential which does not present a strong repulsion at short distances.…
The integral relations formalism introduced in \cite{bar09,rom11}, and designed to describe 1+$N$ reactions, is extended here to collision energies above the threshold for the target breakup. These two relations are completely general, and…
We develop an experimental technique for rf-association of Efimov trimers from three-atoms continuum. We apply it to probe the lowest accessible Efimov energy level in bosonic lithium in the region where strong deviations from the universal…
The behaviour of rod-coil diblock copolymers close to a surface is discussed by using extended scaling methods. The copolymers are immersed in selective solvent such that the rods are likely to aggregate to gain energy. The rods are assumed…