Related papers: Au40: A Large Tetrahedral Magic Cluster
The ground-state electronic, structural, and magnetic properties of small silver clusters, Ag$_n$ (2$\le$n$\le$22), have been studied using a linear combination of atomic Gaussian-type orbitals within the density functional theory. The…
We present the results of over 90 tight-binding molecular-dynamics simulations of collisions between three- and five-atom silicon clusters, at a system temperature of 2000K. Much the most likely products are found to be two 'magic'…
A stable core-shell structure with Ih symmetry, Au12@Au30, has been investigated by first-principles calculations. It is composed of an icosahedron core and an icosidodecahedron shell. The stability of the core-shell Au42 structure is…
Tight-binding molecular dynamics (TBMD) is used to study the structural and electronic properties of silver clusters. The ground state structures of Ag clusters up to 21 atoms are optimized via TBMD combined with genetic algorithm (GA). The…
Using the relativistic all-electron density-functional calculations on the AuN (N=2-26) in the generalized gradient approximation, combined with the guided simulated annealing, we have found that the two- to three-dimensional structural…
The excitation energies of parahydrogen clusters have been systematically calculated by the diffusion Monte Carlo technique in steps of one molecule from 3 to 40 molecules. These clusters possess a very rich spectra, with angular momentum…
We clarify the natural cluster algebra of type A that exists in a residual and tropical form in the kinematical space as suggested in 1711.09102 by the use of triangulations, mutations and associahedron on the definition of scattering…
The cold dark matter (CDM) scenario for structure formation in the Universe is very attractive and has many successes; however, when its spectrum of density perturbations is normalized to the COBE anisotropy measurement the level of…
We report on the structures of aluminum hydrides derived from a tetrahedral aluminum Al4 cluster using ab initio quantum chemical calculation. Our calculation of binding energies of the aluminum hydrides reveals that stability of these…
The energetic ground state of gold clusters with up to 314 atoms consists of rather complicated geometries that have only a weak resemblance to the perfect icosahedra, decahedra and octahedra that are encountered for some magic numbers. The…
We report on the results of the calculations of the low energy excitation patterns for three Zirconium isotopes, viz. $^{80}$Zr$_{40}$, $^{96}$Zr$_{56}$ and $^{110}$Zr$_{70}$, reported by other authors to be doubly-magic tetrahedral nuclei…
We present an asymptotically optimal generalized measurement for the Classical information that is retrieved from a quantum tetrahedron is intrinsically fuzzy. We present an asymptotically optimal generalized measurement for the extraction…
Having a detailed theoretical knowledge of the low-energy structure of the heavy odd-mass nucleus $^{197}$Au is of prime interest as the structure of this isotope represents an important input to theoretical simulations of collider…
We study random 2-dimensional complexes in the Linial - Meshulam model and prove that for the probability parameter satisfying $$p\ll n^{-46/47}$$ a random 2-complex $Y$ contains several pairwise disjoint tetrahedra such that the 2-complex…
Using the embedded-atom method, the structure of small copper clusters on Au(111) electrodes has been investigated both by static and dynamic calculations. By varying the size of roughly circular clusters, the edge energy per atom is…
The interplay between magic number stabilities and superfluidity of small para-hydrogen clusters with sizes $N = 5$ to 40 and temperatures $0.5 K \leq T \leq 4.5 $K is explored with classical and quantum Path Integral Monte Carlo…
We study why gold forms planar and cage-like clusters while copper and silver do not. We use density functional theory and norm-conserving pseudo-potentials with and without a scalar relativistic component. For the exchange-correlation…
Spherical nanoclusters and nanoparticles are rising materials whose functional design provides many useful applications ranging from catalysis, molecular sensing, gas storage to drug targeting and delivery. Here, we develop phenomenological…
Convergent semiclassical trace formulae for the density of states and cohesive force of a narrow constriction in an electron gas, whose classical motion is either chaotic or integrable, are derived. It is shown that mode quantization in a…
We suggest that recent neutrino puzzles that are the solar and atmospheric neutrino deficits as well as the possible neutrino oscillations reported by the LSND experiment and the possibility of massive neutrinos providing the hot component…