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The nuclear shell model is a benchmark for the description of the structure of atomic nuclei. The magic numbers associated with closed shells have long been assumed to be valid across the whole nuclear chart. Investigations in recent years…
Icosahedral Au clusters with three and four shells of atoms are found to deviate significantly from the commonly assumed Mackay structures. By introducing additional atoms in the surface shell and creating a vacancy in the center of the…
Structural and dynamical characteristics pertaining to the solvation of an excess proton in liquid-like nanoclusters of the type [H$_2$O]$_n$ are investigated using Molecular Dynamics experiments. Three different aggregate sizes were…
Compact object clusters are likely to exist in the centre of some galaxies because of mass segregation. The high densities and velocities reached in them deserves a better understanding. The formation of binaries and their subsequent…
The electronic properties of the oxygen molecule, in its singlet and triplet states, and of many small oxygen-containing radicals and anions have important roles in different fields of Chemistry, Biology and Atmospheric Science.…
Systematic odd-even binding energy differences in finite metallic particles are usually attributed to mean-field orbital energy effects or to a coherent pairing interaction. We show analytically and numerically that a purely random two-body…
The transition from order to chaos has been a major subject of research since the work of Poincare, as it is relevant in areas ranging from the foundations of statistical physics to the stability of the solar system. Along this transition,…
Peculiarities of the intermolecular rovibrational quantum dynamics of the methane-argon complex are studied using a new, ab initio potential energy surface [Y. N. Kalugina, S. E. Lokshtanov, V. N. Cherepanov, and A. A. Vigasin, J. Chem.…
Ground-state and excited-state properties of vertically coupled double quantum dots are studied by exact diagonalization. Magic-number total angular momenta that minimize the total energy are found to reflect a crossover between electron…
Compact groups of galaxies have posed a number of challenging questions. Intensive observational and theoretical studies are now providing answers to many of these, and at the same time, are revealing unexpected new clues about the nature…
We extend correlated sampling from classical auxiliary-field quantum Monte Carlo to the quantum-classical (QC-AFQMC) framework, enabling accurate nuclear force computations crucial for geometry optimization and reaction dynamics. Stochastic…
The lowest energy configurations of Cn(n =< 55) clusters are obtained using the energy mini- mization technique with the conjugate gradient (CG) method where a modified Brenner potential is invoked to describe the carbon and hydrocarbon…
The geometric and electronic structures of NaN, CuN, and AgN metal clusters are systematically studied based on the density functional theory over a wide range of cluster sizes 2=<N=<75. A remarkable similarity is observed between the…
We have located the global minimum for all lead clusters with up to 160 atoms using a glue potential to model the interatomic interactions. The lowest-energy structures are not face-centred cubic as suggested previously. Rather, for N<40…
Protoplanets of Super-Earth sizes may get trapped in convergence zones for planetary migration and form gas giants there. These growing planets undergo accretion heating, which triggers a hot-trail effect that can reverse migration…
One-dimensional world is very unusual as there is an interplay between quantum statistics and geometry, and a strong short-range repulsion between atoms mimics Fermi exclusion principle, fermionizing the system. Instead, a system with a…
The properties of a balanced two-component Fermi gas in a one-dimensional harmonic trap are studied by means of the coupled cluster method. For few fermions we recover the results of exact diagonalization, yet with this method we are able…
Strongly correlated many-body systems often display the emergence of simple patterns and regular behaviour of their global properties. Phenomena such as clusterization, collective motion and appearance of shell structures are commonly…
We investigate the self-organization of point-particles with short-range interactions modeled via simple 1D and 2D Hubbard-like models. We show how various properties emerge such as, boson-like ordering leading to topological structures in…
Ultracold atomic spin mixtures develop rich and intriguing magnetic properties when an external radiation coherently couples different spin states. In particular, the coupled mixture may acquire a critical behavior when the spin…