相关论文: Vibrational behaviour of a realistic amorphous-sil…
We have adapted classical molecular dynamics to study the structural and dynamical properties of amorphous silica surfaces. Concerning the structure, the density profile exhibits oscillations perpendicularly to the surface as observed in…
Amorphous solids are dynamically inhomogeneous due to in lack of translational symmetry and hence exhibit vibrational properties different from crystalline solids with anomalous low frequency vibrational density of states (VDOS) and related…
Using the fact that the comoving angular diameter distance to the last scattering surface is strictly constrained almost model independently, we show that, for any model agreeing with the standard $\Lambda$CDM model on its background…
Densities and transition densities are computed in an equilateral triangular alpha-cluster model for $^{12}$C, in which each $\alpha$ particle is taken as a gaussian density distribution. The ground-state, the symmetric vibration (Hoyle…
Current simulations of ultraviolet-visible absorption lineshapes, and dynamics of condensed phase systems, largely adopt a harmonic description to model vibrations. Often, this involves a model of displaced harmonic oscillators that have…
We consider a two-body quantum system in dimension one composed by a test particle interacting with an harmonic oscillator placed at the position $a>0$. At time zero the test particle is concentrated around the position $R_0$ with average…
Internal friction and speed of sound of a-SiO(2) was measured above 6 mK using a torsional oscillator at 90 kHz, controlling for thermal decoupling, non-linear effects, and clamping losses. Strain amplitudes e(A) = 10^{-8} mark the…
Molecular dynamics simulations are performed to investigate heterogeneous dynamics in amorphous glassy materials under oscillatory shear strain. We consider three-dimensional binary Lennard-Jones mixture well below the glass transition…
Helioseismic signatures of dynamo waves have recently been discovered in variations of the solar differential rotation, offering valuable insights into the type of dynamo mechanism operating in the solar convection zone. To characterize…
We present a systematic understanding of the rotational structure of a long-range (vibrationally highly-excited) diatomic molecule. For example, we show that depending on a quantum defect, the least-bound vibrational state of a diatomic…
Hydrogenation of amorphous silicon (a-Si:H) is critical for reducing defect densities, passivating mid-gap states and surfaces, and improving photoconductivity in silicon-based electro-optical devices. Modelling the atomic scale structure…
An analysis is provided of the degradation that arises in the quality factor of a whispering gallery mode when a circular or spherical dielectric cavity is deformed. The large quality factors of such resonators are important to their use in…
All vibrational energies of the (trans-, cis-, delocalized-) formic acid molecule are converged up to 4500 cm$^{-1}$ beyond the zero-point vibrational energy with the GENIUSH-Smolyak variational approach and using an ab initio potential…
Radiative diffusion damps acoustic modes at large comoving wavenumber (k) before decoupling (``Silk damping''). In a simple WKB analysis, neglecting moments of the temperature distribution beyond the quadrupole, damping appears in the…
We present a first-principles study of the structural, electronic, and optical properties of hydrogenated amorphous silicon (a-Si:H). To this end, atomic configurations of a-Si:H with 72 and 576 atoms respectively are generated using…
The analytical solution is given for a vibrating rigid core sphere, oscillating up and down without volume change, situated at the center of an elastic material spherical shell, which in turn is situated inside an infinite (possible…
We have studied the normal modes of hydrogenated and oxidized silicon nanocrystals, namely SiH4 (silan), H2SiO (silanon), Si10H16 and Si10H14O. The small clusters (SiH4 and H2SiO) have been used for convergence tests and their bondlengths…
We investigate the mass profile of LambdaCDM halos using a suite of numerical simulations spanning five decades in halo mass, from dwarf galaxies to rich galaxy clusters. Our analysis confirms the proposal of Navarro, Frenk & White (NFW)…
In this study, we present the ro-vibrationally resolved gas-phase spectrum of the diatomic molecule TiO around 1000\,cm$^{-1}$. Molecules were produced in a laser ablation source by vaporizing a pure titanium sample in the atmosphere of…
Aims. We studied the manifestation of decayless oscillations in 3D simulations of coronal loops, driven by random motions. Methods. Using the PLUTO code, we ran magnetohydrodynamic (MHD) simulations of a straight gravitationally stratified…