Search results for "Correlation function"
showing 10 items of 164 documents
Dynamical heterogeneities in a supercooled Lennard-Jones liquid
1997
We present the results of a large scale molecular dynamics computer simulation study in which we investigate whether a supercooled Lennard-Jones liquid exhibits dynamical heterogeneities. We evaluate the non-Gaussian parameter for the self part of the van Hove correlation function and use it to identify ``mobile'' particles. We find that these particles form clusters whose size grows with decreasing temperature. We also find that the relaxation time of the mobile particles is significantly shorter than that of the bulk, and that this difference increases with decreasing temperature.
Nonlinear active micro-rheology in a glass-forming soft-sphere mixture.
2013
We present extensive molecular dynamics computer simulations of a glass-forming Yukawa mixture, investigating the nonlinear response of a single particle that is pulled through the system by a constant force. Structural changes around the pulled particle are analyzed by pair correlation functions, measured in the deeply supercooled state of the system. A regime of intermediate force strengths is found where the structural changes around the pulled particle are small, although its steady-state velocity shows a strong nonlinear response. This nonlinear response regime is characterized by a force-temperature superposition principle of a Peclet number and anisotropic diffusive behavior. In the …
Reply to “Comment on ‘Elastic constants from microscopic strain fluctuations’ ”
2010
We agree with Coupier et al. [Phys. Rev. E 81, 013101 (2010)] that their technique for extracting elastic constants from microscopic strain fluctuations improves upon ours because of a more accurate computation of the integral of the elastic correlation function over sub-blocks. However, we believe that their interpretation of the physical relevance of the elastic correlation length extracted from the fits is misleading.
Monte Carlo simulation of dimensional crossover in the XY model.
1993
We report Monte Carlo simulations of Villain's periodic Gaussian XY model on ${\mathit{L}}^{2}$\ifmmode\times\else\texttimes\fi{}N lattices of film geometry (L\ensuremath{\gg}N) with up to N=16 layers, employing the single-cluster update algorithm combined with improved estimators for measurements. The boundary conditions are periodic within each layer and free at the bottom and top layer. Based on data for the specific heat, the spin-spin correlation function, and the susceptibility in the high-temperature phase we study the crossover from three- to two-dimensional behavior as criticality is approached. For the transition temperatures, determined from Kosterlitz-Thouless fits to the correl…
Collective atomic effects in resonance fluorescence
1977
We suggest that the statistical properties of the scattered radiation in resonance-fluorescence experiments may be affected significantly by the existence of atomic correlations. The scattered light spectrum from two- and three-atom collective systems has been calculated and compared with the one-atom spectrum. The differences are quite significant for weak fields, but become less pronounced as the intensity of the driving field is increased. In addition, we have calculated the scattered intensity correlation function for collectively interacting systems, and found that its behavior is very different from that of the single-atom intensity correlation function, both for weak and strong incid…
Test of the semischematic model for a liquid of linear molecules
1998
We apply to a liquid of linear molecules the semischematic mode-coupling model, previously introduced to describe the center of mass (COM) slow dynamics of a network-forming molecular liquid. We compare the theoretical predictions and numerical results from a molecular dynamics simulation, both for the time and the wave-vector dependence of the COM density-density correlation function. We discuss the relationship between the presented analysis and the results from an approximate solution of the equations from molecular mode-coupling theory [R. Schilling and T. Scheidsteger, Phys. Rev. E 56 2932 (1997)].
Probing slow fluctuations in nonergodic systems: Interleaved sampling technique
2007
We present a new dynamic light scattering scheme to obtain ensemble-averaged correlation functions of slow fluctuations in non-ergodic systems in an efficient way. On a rotating sample, a large set of separate correlation functions is measured in parallel, for each independent orientational component of the sample’ density fluctuations. The ensemble-averaged correlation function spans a lag time range from 1 to 104 s. We describe our first implementation of this technique, discuss its statistical accuracy and show first results. Compared to plain ensemble averaging over a series of N measurements, the total measurement time is usualy reduced by a factor N without significant degradation of …
Local correlation functional for electrons in two dimensions
2008
We derive a local approximation for the correlation energy in two-dimensional electronic systems. In the derivation we follow the scheme originally developed by Colle and Salvetti for three dimensions, and consider a Gaussian approximation for the pair density. Then, we introduce an ad-hoc modification which better accounts for both the long-range correlation, and the kinetic-energy contribution to the correlation energy. The resulting functional is local, and depends parametrically on the number of electrons in the system. We apply this functional to the homogeneous electron gas and to a set of two-dimensional quantum dots covering a wide range of electron densities and thus various amount…
Monte Carlo studies ofd= 2 Ising strips with long-range boundary fields
2000
A two-dimensional Ising model with nearest-neighbour ferromagnetic exchange confined in a strip of width L between two parallel boundaries is studied by Monte Carlo simulations. `Free' boundaries are considered with unchanged exchange interactions at the boundary but long-range boundary fields of the form H (n ) = ? h [n -3 - (L - n + 1) -3 ], where n = 1, 2, ... ,L labels the rows across the strip. In the case of competing fields and L , the system exhibits a critical wetting transition of a similar type as in the well studied case of short-range boundary fields. At finite L , this wetting transition is replaced by a (rounded) interface localization-delocalization transition at Tc (h , L )…
Point field models for the galaxy point pattern modelling the singularity of the two-point correlation function
2002
There is empirical evidence that the two-point correlation function of the galaxy distribution follows, for small scales, reasonably well a power-law expression $\xi(r)\propto r^{-\gamma}$ with $\gamma$ between 1.5 and 1.9. Nevertheless, most of the point field models suggested in the literature do not have this property. This paper presents a new class of models, which is produced by modifying point fields commonly used in cosmology to mimic the galaxy distribution, but where $\gamma=2$ is too large. The points are independently and randomly shifted, leading to the desired reduction of the value of $\gamma$.