Search Results (19)

In the present work, we suggest a new approach for studying the equilibrium states of an hydrodynamic isothermal turbulent self-gravitating system as a statistical model for a molecular cloud. The main hypothesis is that the local turbulent motion of the fluid elements is purely chaotic and can be regarded as a perfect gas. Then, the turbulent kinetic energy per fluid element can be substituted for the temperature of the chaotic motion of the fluid elements. Using this, we write down effective formulae for the internal and total the energy and for the first principal of thermodynamics. Then, we obtain expressions for the entropy, the free energy, and the Gibbs potential. Searching for equilibrium states, we explore two possible systems: the canonical ensemble and the grand canonical ensemble. Studying the former, we conclude that there is no extrema for the free energy. Through the latter system, we obtain a minimum of the Gibbs potential when the macro-temperature and pressure of the cloud are equal to those of the surrounding medium. This minimum corresponds to a possible stable local equilibrium state of our system. Full article

The first part of this work provides a review of recent research on generalised entropies and their origin, as well as its application to black hole thermodynamics. To start, it is shown that the Hawking temperature and the Bekenstein–Hawking entropy are, respectively, the only possible thermodynamical temperature and entropy of the Schwarzschild black hole. Moreover, it is investigated if the other known generalised entropies, which include Rényi’s entropy, Tsallis entropy, and the four- and five-parameter generalised entropies, could correctly yield the Hawking temperature and the ADM mass. The possibility that generalised entropies could describe hairy black hole thermodynamics is also considered, both for the Reissner–Nordström black hole and for Einstein’s gravity coupled with two scalar fields. Two possibilities are investigated, namely, the case when the ADM mass does not yield the Bekenstein–Hawking entropy, and the case in which the effective mass expressing the energy inside the horizon does not yield the Hawking temperature. For the model with two scalar fields, the radii of the photon sphere and of the black hole shadow are calculated, which gives constraints on the BH parameters. These constraints are seen to be consistent, provided that the black hole is of the Schwarzschild type. Subsequently, the origin of the generalised entropies is investigated, by using their microscopic particle descriptions in the frameworks of a microcanonical ensemble and canonical ensemble, respectively. Finally, the McLaughlin expansion for the generalised entropies is used to derive, in each case, the microscopic interpretation of the generalised entropies, via the canonical and the grand canonical ensembles. Full article

For finite systems the thermodynamic potentials are not equivalent. Thus, in any of them the fluctuations induce different forces: Casimir force (CF) in the grand canonical ensemble (GCE) and Helmholtz force (HF) in the canonical (CE) one with fixed magnetization. Here, we consider the HF within the Nagle–Kardar model with periodic boundary conditions. The model represents a one-dimensional Ising chain with both nearest nearest-neighbor short-ranged and long-ranged interactions present in it. The nearest-neighbor interactions of strength $J_s$ could be either ferromagnetic ($J_s>0$), or antiferromagnetic ($J_s<0$). The long-ranged equivalent-neighbor ferromagnetic interactions are of strength $J_l/N>0$. In the thermodynamic limit the model exhibits in the $(K_s=\beta J_s,K_l=\beta J_l)$ plane a second-order phase transition line $2K_l=exp\left(-2K_s\right)$, with $K_s>-ln\left(3\right)/4$, which ends at a tricritical point $(K_l=\sqrt{3}/2,K_s=-ln\left(3\right)/4)$. The obtained results demonstrate that the temperature behavior of the HF differs essentially from the one of the CF. Furthermore, we show that the CE and GCE are not equivalent, even in the thermodynamic limit. Finally, in the $\{K_s,K_l,m\}$ phase space we determine the regions of stable states of the system. Full article

Recent studies revealed anomalous underscreening in concentrated electrolytes, and we suggest that the underscreened electrostatic forces between membrane proteins play a significant role in the process of self-assembly. In this work, we assumed that the underscreened electrostatic forces compete with the thermodynamic Casimir forces induced by concentration fluctuations in the lipid bilayer, and developed a simplified model for a binary mixture of oppositely charged membrane proteins with different preference to liquid-ordered and liquid-disordered domains in the membrane. In the model, like macromolecules interact with short-range Casimir attraction and long-range electrostatic repulsion, and the cross-interaction is of the opposite sign. We determine energetically favored patterns in a system in equilibrium with a bulk reservoir of the macromolecules. Different patterns consisting of clusters and stripes of the two components and of vacancies are energetically favorable for different values of the chemical potentials. Effects of thermal flutuations at low temperature are studied using Monte Carlo simulations in grand canonical and canonical ensembles. For fixed numbers of the macromolecules, a single two-component cluster with a regular pattern coexists with dispersed small one-component clusters, and the number of small clusters depends on the ratio of the numbers of the molecules of the two components. Our results show that the pattern formation is controlled by the shape of the interactions, the density of the proteins, and the proportion of the components. Full article

We analyze the general relation between canonical and grand canonical ensembles in the thermodynamic limit. We begin our discussion by deriving, with an alternative approach, some standard results first obtained by Kac and coworkers in the late 1970s. Then, motivated by the Bose–Einstein condensation (BEC) of trapped gases with a fixed number of atoms, which is well described by the canonical ensemble and by the recent groundbreaking experimental realization of BEC with photons in a dye-filled optical microcavity under genuine grand canonical conditions, we apply our formalism to a system of non-interacting Bose particles confined in a two-dimensional harmonic trap. We discuss in detail the mathematical origin of the inequivalence of ensembles observed in the condensed phase, giving place to the so-called grand canonical catastrophe of density fluctuations. We also provide explicit analytical expressions for the internal energy and specific heat and compare them with available experimental data. For these quantities, we show the equivalence of ensembles in the thermodynamic limit. Full article

Surface charges of catalysts have important influences on the thermodynamics and kinetics of electrochemical reactions. Herein, we develop a modified version of the grand-canonical potential kinetics (GCP-K) method based on density functional theory (DFT) calculations to explore the effect of surface charges on reaction thermodynamics and kinetics. Using the hydrogen evolution reaction (HER) on the Pt(111) surface as an example, we show how to track the change of surface charge in a reaction and how to analyze its influence on the kinetics. Grand-canonical calculations demonstrate that the optimum hydrogen adsorption energy on Pt under the standard hydrogen electrode condition (SHE) is around −0.2 eV, rather than 0 eV established under the canonical ensemble, due to the high density of surface negative charges. By separating the surface charges that can freely exchange with the external electron reservoir, we obtain a Tafel barrier that is in good agreement with the experimental result. During the Tafel reaction, the net electron inflow into the catalyst leads to a stabilization of canonical energy and a destabilization of the charge-dependent grand-canonical component. This study provides a practical method for obtaining accurate grand-canonical reaction energetics and analyzing the surface charge induced changes. Full article

The thermodynamic properties of the interacting particle–antiparticle boson system at high temperatures and densities were investigated within the framework of scalar and thermodynamic mean-field models. We assume isospin (charge) density conservation in the system. The equations of state and thermodynamic functions are determined after solving the self-consistent equations. We study the relationship between attractive and repulsive forces in the system and the influence of these interactions on the thermodynamic properties of the bosonic system, especially on the development of the Bose–Einstein condensate. It is shown that under “weak” attraction, the boson system has a phase transition of the second order, which occurs every time the dependence of the particle density crosses the critical curve or even touches it. It was found that with a “strong” attractive interaction, the system forms a Bose condensate during a phase transition of the first order, and, despite the finite value of the isospin density, these condensate states are characterized by a zero chemical potential. That is, such condensate states cannot be described by the grand canonical ensemble since the chemical potential is involved in the conditions of condensate formation, so it cannot be a free variable when the system is in the condensate phase. Full article

The aim of the present paper is to provide a preliminary investigation of the thermodynamics of particles obeying monotone statistics. To render the potential physical applications realistic, we propose a modified scheme called block-monotone, based on a partial order arising from the natural one on the spectrum of a positive Hamiltonian with compact resolvent. The block-monotone scheme is never comparable with the weak monotone one and is reduced to the usual monotone scheme whenever all the eigenvalues of the involved Hamiltonian are non-degenerate. Through a detailed analysis of a model based on the quantum harmonic oscillator, we can see that: (a) the computation of the grand-partition function does not require the Gibbs correction factor $n!$ (connected with the indistinguishability of particles) in the various terms of its expansion with respect to the activity; and (b) the decimation of terms contributing to the grand-partition function leads to a kind of “exclusion principle” analogous to the Pauli exclusion principle enjoined by Fermi particles, which is more relevant in the high-density regime and becomes negligible in the low-density regime, as expected. Full article

We study the thermodynamic limit of very long walks on finite, connected, non-random graphs subject to possible random modifications and transportation capacity noise. As walks might represent the chains of interactions between system units, statistical mechanics of very long walks may be used to quantify the structural properties important for the dynamics of processes defined in networks. Networks open to random structural modifications are characterized by a Fermi–Dirac distribution of node’s fugacity in the framework of grand canonical ensemble of walks. The same distribution appears as the unique stationary solution of a discrete Fokker–Planck equation describing the time evolution of probability distribution of stochastic processes in networks. Nodes of inferior centrality are the most likely candidates for the future structural changes in the network. Full article

An important yet perplexing result from work in the 1990s and 2000s is the near-unity value of the ratio of fluctuations in the vacuum energy density of quantum fields to the mean in a collection of generic spacetimes. This was carried out by way of calculating the noise kernels which are the correlators of the stress-energy tensor of quantum fields. In this paper, we revisit this issue via a quantum thermodynamics approach, by calculating two quintessential thermodynamic quantities: the heat capacity and the quantum compressibility of some model geometries filled with a quantum field at high and low temperatures. This is because heat capacity at constant volume gives a measure of the fluctuations of the energy density to the mean. When this ratio approaches or exceeds unity, the validity of the canonical distribution is called into question. Likewise, a system’s compressibility at constant pressure is a criterion for the validity of grand canonical ensemble. We derive the free energy density and, from it, obtain the expressions for these two thermodynamic quantities for thermal and quantum fields in 2d Casimir space, 2d Einstein cylinder and 4d ($S^1\times S^3$ ) Einstein universe. To examine the dependence on the dimensionality of space, for completeness, we have also derived these thermodynamic quantities for the Einstein universes with even-spatial dimensions: $S^1\times S^2$ and $S^1\times S^4$. With this array of spacetimes we can investigate the thermodynamic stability of quantum matter fields in them and make some qualitative observations on the compatibility condition for the co-existence between quantum fields and spacetimes, a fundamental issue in the quantum and gravitation conundrum. Full article

Since the grand partition function $Z_q$ for the so-called q-particles (i.e., quons), $q\in (-1,1)$, cannot be computed by using the standard 2nd quantisation technique involving the full Fock space construction for $q=0$, and its q-deformations for the remaining cases, we determine such grand partition functions in order to obtain the natural generalisation of the Plank distribution to $q\in [-1,1]$. We also note the (non) surprising fact that the right grand partition function concerning the Boltzmann case (i.e., $q=0$) can be easily obtained by using the full Fock space 2nd quantisation, by considering the appropriate correction by the Gibbs factor $1/n!$ in the n term of the power series expansion with respect to the fugacity z. As an application, we briefly discuss the equations of the state for a gas of free quons or the condensation phenomenon into the ground state, also occurring for the Bose-like quons $q\in (0,1)$. Full article

The ideal gas model is an important and useful model in classical thermodynamics. This remains so for small systems. Molecules in a gas can be adsorbed on the surface of a sphere. Both the free gas molecules and the adsorbed molecules may be modeled as ideal for low densities. The adsorption energy, $U^s$, plays an important role in the analysis. For small adsorbents this energy depends on the curvature of the adsorbent. We model the adsorbent as a sphere with surface area $\Omega =4\pi R^2$, where R is the radius of the sphere. We calculate the partition function for a grand canonical ensemble of two-dimensional adsorbed phases. When connected with the nanothermodynamic framework this gives us the relevant thermodynamic variables for the adsorbed phase controlled by the temperature T, surface area $\Omega$, and chemical potential $\mu$. The dependence of intensive variables on size may then be systematically investigated starting from the simplest model, namely the ideal adsorbed phase. This dependence is a characteristic feature of small systems which is naturally expressed by the subdivision potential of nanothermodynamics. For surface problems, the nanothermodynamic approach is different, but equivalent to Gibbs’ surface thermodynamics. It is however a general approach to the thermodynamics of small systems, and may therefore be applied to systems that do not have well defined surfaces. It is therefore desirable and useful to improve our basic understanding of nanothermodynamics. Full article

The micro-canonical, canonical, and grand canonical ensembles of walks defined in finite connected undirected graphs are considered in the thermodynamic limit of infinite walk length. As infinitely long paths are extremely sensitive to structural irregularities and defects, their properties are used to describe the degree of structural imbalance, anisotropy, and navigability in finite graphs. For the first time, we introduce entropic force and pressure describing the effect of graph defects on mobility patterns associated with the very long walks in finite graphs; navigation in graphs and navigability to the nodes by the different types of ergodic walks; as well as node’s fugacity in the course of prospective network expansion or shrinking. Full article

The event-shape and multiplicity dependence of the chemical freeze-out temperature ($T_{\mathrm{ch}}$), freeze-out radius (R), and strangeness saturation factor (${\gamma }_s$) are obtained by studying the particle yields from the PYTHIA8 Monte Carlo event generator in proton-proton (pp) collisions at the centre-of-mass $\sqrt{s}$ = 13 TeV. Spherocity is one of the transverse event-shape techniques to distinguish jetty and isotropic events in high-energy collisions and helps in looking into various observables in a more differential manner. In this study, spherocity classes are divided into three categories, namely (i) spherocity integrated, (ii) isotropic, and (iii) jetty. The chemical freeze-out parameters are extracted using a statistical thermal model as a function of the spherocity class and charged particle multiplicity in the canonical, strangeness canonical, and grand canonical ensembles. A clear observation of the multiplicity and spherocity class dependence of $T_{\mathrm{ch}}$, R, and ${\gamma }_s$ is observed. A final state multiplicity, $N_{\mathrm{ch}}\ge$ 30 in the forward multiplicity acceptance of the ALICE detector appears to be a thermodynamic limit, where the freeze-out parameters become almost independent of the ensembles. This study plays an important role in understanding the particle production mechanism in high-multiplicity pp collisions at the Large Hadron Collider (LHC) energies in view of a finite hadronic phase lifetime in small systems. Full article

Mesenchymal stromal cells (MSCs) were obtained from human bone marrow and amplified in cultures supplemented with human platelet lysate. Once semi-confluent, cells were seeded in solid collagen scaffolds that were rapidly colonized by the cells generating a 3D cell scaffold. Here, they acquired a myofibroblast phenotype and when exposed to appropriate chemical stimulus, developed tension and cell shortening, similar to those of striated and smooth muscle cells. Myofibroblasts contained a molecular motor—the non-muscle myosin type IIA (NMMIIA) whose crossbridge (CB) kinetics are dramatically slow compared with striated and smooth muscle myosins. Huxley’s equations were used to determine the molecular mechanical properties of NMMIIA. Thank to the great number of NMMIIA molecules, we determined the statistical mechanics (SM) of MSCs, using the grand canonical ensemble which made it possible to calculate various thermodynamic entities such as the chemical affinity, statistical entropy, internal energy, thermodynamic flow, thermodynamic force, and entropy production rate. The linear relationship observed between the thermodynamic force and the thermodynamic flow allowed to establish that MSC-laden in collagen scaffolds were in a near-equilibrium stationary state (affinity ≪ RT), MSCs were also seeded in solid collagen scaffolds functionalized with the tripeptide Arg-Gly-Asp (RGD). This induced major changes in NMMIIA SM particularly by increasing the rate of entropy production. In conclusion, collagen scaffolds laden with MSCs can be viewed as a non-muscle contractile bioengineered tissue operating in a near-equilibrium linear regime, whose SM could be substantially modified by the RGD peptide. Full article