Related papers: Calculation of the entropy for hard-sphere from in…
A key challenge for soft materials design and coarse-graining simulations is determining interaction potentials between components that give rise to desired condensed-phase structures. In theory, the Ornstein-Zernike equation provides an…
We discuss the properties of invariant measures corresponding to iterated function systems (IFSs) with place-dependent probabilities and compute their Renyi entropies, generalized dimensions, and multifractal spectra. It is shown that with…
This article deals with the error estimates for numerical approximations of the entropy solutions of coupled systems of nonlocal hyperbolic conservation laws. The systems can be strongly coupled through the nonlocal coefficient present in…
A numerical model is built, simulating the principles of kinetic gas theory, to predict pressures of molecules in a spherical pressure vessel; the model tracks a single particle and multiplies the force on the spherical walls by a mole of…
A recently derived method [R. D. Rohrmann and A. Santos, Phys. Rev. E. {\bf 76}, 051202 (2007)] to obtain the exact solution of the Percus-Yevick equation for a fluid of hard spheres in (odd) $d$ dimensions is used to investigate the…
We apply the statistical measure of complexity, introduced by L\'{o}pez-Ruiz, Mancini and Calbet to a hard-sphere dilute Fermi gas whose particles interact via a repulsive hard-core potential. We employ the momentum distribution of this…
The hard sphere system plays a basic role in condensed matter physics and related fields, and equation of state (EoS) is the ultimate solution to its thermodynamic properties (1-3). Dozens of EoSs have been proposed since van der Waals…
The equation of state of the SU($3$) Yang-Mills theory is determined in the deconfined phase with a precision of about 0.5%. The calculation is carried out by numerical simulations of lattice gauge theory with shifted boundary conditions in…
The entropy change of a (non-equilibrium) Markovian ensemble is calculated from (1) the ensemble phase density $p(t)$ evolved as iterative map, $p(t) = \mathbb{M}(t) p(t- \Delta t)$ under detail balanced transition matrix $\mathbb{M}(t)$,…
We have studied the structure and thermodynamic properties of isotropic three-dimensional core-softened fluid by using the second-order Ornstein-Zernike integral equations completed by the hypernetted chain and Percus-Yevick closures. The…
Entropy functionals are computed for non-stationary distributions of particles of Lorentz gas and hard disks. The distributions consisting of beams of particles are found to have the largest amount of entropy and entropy increase. The…
We calculate the entanglement entropy for a sphere and a massless scalar field in any dimensions. The reduced density matrix is expressed in terms of the infinitesimal generator of conformal transformations keeping the sphere fixed. The…
Characterizing the entropy of a system is a crucial, and often computationally costly, step in understanding its thermodynamics. It plays a key role in the study of phase transitions, pattern formation, protein folding and more. Current…
A kinetic equation for a dilute gas of hard spheres confined between two parallel plates separated a distance smaller than two particle dimeters is derived. It is a Boltzmann-like equation, which incorporates the effect of the confinement…
The kinetic theory for a fluid of hard spheres which undergo endothermic and/or exothermic reactions with mass transfer is developed. The exact balance equations for concentration, density, velocity and temperature are derived. The Enskog…
We prove a proposition that the entropy of the system composed of finite $N$ molecules of ideal gas is the $q$-entropy or Havrda-Charv\'at-Tsallis entropy, which is also known as Tsallis entropy, with the entropic index…
We present a maximum entropy approach to analyze the internal dynamics of a small system in contact with a large bath e.g. a solute-solvent system. For the small solute, the fluctuations around the mean values of observables are not…
Using the formalism of the Khalatnikov potential, we derive exact general formulae for the entropy flow dS/dy, where y is the rapidity, as a function of temperature for the (1+1) relativistic hydrodynamics of a perfect fluid. We study in…
We calculate the quantum Renyi entropy in a phase space representation for either fermions or bosons. This can also be used to calculate purity and fidelity, or the entanglement between two systems. We show that it is possible to calculate…
Hydrodynamic equations for a binary mixture of inelastic hard spheres are derived from the Boltzmann kinetic theory. A normal solution is obtained via the Chapman-Enskog method for states near the local homogeneous cooling state. The mass,…