Related papers: Solid molecular hydrogen: The Broken Symmetry Phas…
The systematic shifts of the transition frequencies in the molecular hydrogen ions are of relevance to ultra-high-resolution radio-frequency, microwave and optical spectroscopy of these systems, performed in ion traps. We develop the…
Quantum chaotic dynamics is obtained for a tight-binding model in which the energies of the atomic levels at the boundary sites are chosen at random. Results for the square lattice indicate that the energy spectrum shows a complex behavior…
In this paper we revisit the onset of the instability of the solid state in classical systems within self-consistent phonon theory (SCPT). Spanning the whole phase diagram versus volume and versus pressure, we identify two different kinds…
Recent experiments have confirmed the existence of rotational bands in the A \~ 110 mass region with very extended shapes lying between super- and hyper-deformation. Using the projected shell model, we make a first attempt to describe…
Solid CO2 phase I was studied using the pressure-constant NPT Monte Carlo simulation and the Kihara core potential in the temperature range below 194 K and the pressure range below 10 GPa. At a pressure of 1 bar, the temperature dependence…
We propose an alternative to the usual time--independent Born--Oppenheimer approximation that is specifically designed to describe molecules with non--symmetrical hydrogen bonds. In our approach, the masses of the hydrogen nuclei are scaled…
We conducted replica exchange Monte Carlo simulations to investigate the phase diagram of identical hard rhombi systems in two dimensions. The rhombi shape varies from nearly square-like, as their minor angle a approaches 90 degrees, to…
The cubic-to-orthorhombic structural transition occurring in CsH at a pressure of about 17 GPa is studied by ab initio calculations. The relative stability of the competing structures and the transition pressure are correctly predicted. We…
We consider a periodic waveguide array whose unit cell consists of a $\mathcal{PT}$-symmetric quadrimer with two competing loss/gain parameter pairs which lead to qualitatively different symmetry-broken phases. It is shown that the…
We report absolute optical frequencies of electronic transitions from the $X\, ^2\Pi_{3/2},v''=0,J''=3/2$ rovibronic ground state to the 12 lowest levels of the $A\, ^2\Sigma^+,v'=0$ vibronic state in $^{16}$OH, as well as to the 16 lowest…
We study the classical dynamics of the collinear positron-hydrogen scattering system below the three-body breakup threshold. Observing the chaotic behavior of scattering time signals, we in- troduce a code system appropriate to a coarse…
We discuss the symmetry of NaV2O5 in the high temperature phase on the basis of optical conductivity data. Conclusive information cannot be obtained by studying the optically allowed lattice vibrations. However, intensity and polarization…
In molecular dynamics simulations of soft glass-formers interacting via repulsions, we find that the glass transition temperature, dynamical heterogeneity, and glass fragility reach their maxima at the same crossover pressure $P_d$. Our…
The hydrogen molecule has become a test ground for quantum electrodynamical calculations in molecules. Expanding beyond studies on stable hydrogenic species to the heavier radioactive tritium-bearing molecules, we report on a measurement of…
Rotation-vibration spectra of the nitric acid molecule, HNO\3, are calculated for wavenumbers up to 7000~\cm. Calculations are performed using a Hamiltonian expressed in internal curvilinear vibrational coordinates solved using a hybrid…
Electronic spectra of C$_6$H are measured in the $18\,950-21\,100$ cm$^{-1}$ domain using cavity ring-down spectroscopy of a supersonically expanding hydrocarbon plasma. In total, 19 (sub)bands of C$_6$H are presented, all probing the…
We present experimental observations of seven vibrational levels $v'=20-26$ of the $1^{3}\Sigma_{g}^{+}$ excited state of Li$_2$ molecules by the photoassociation (PA) of a degenerate Fermi gas of $^6$Li atoms. For each vibrational level,…
We consider hard-core bosons on the kagome lattice in the presence of short range repulsive interactions and focus particularly on the filling factor 1/3. In the strongly interacting limit, the low energy excitations can be described by the…
Recent experimental results on two hcp phases of barium under high pressure show interesting variation of the lattice parameters. They are here interpreted in terms of electronic structure calculation by using the LMTO method and…
The existence of a paradoxical supersolid phase of matter, possessing the apparently incompatible properties of crystalline order and superfluidity, was predicted 50 years ago. Solid helium was the natural candidate, but there supersolidity…