相关论文: Recursive calculation of the microcanonical densit…
We present exact expressions for the sum of states of noninteracting classical and quantum particles occupying a finite number of modes with arbitrary spacings. Exploiting a probabilistic analogy, we derive an analytic fourth-order…
For a homogeneous system divisible into identical, weakly interacting subsystems, the muticanonical procedure can be accelerated if it is first applied to determine of the density of states for a single subsystem. This result is then…
We derive a powerful yet simple method for analyzing the local density of states in gapless one dimensional fermionic systems, including extensions such as momentum dependent interaction parameters and hard-wall boundaries. We study the…
The configurational density of states (CDOS) encodes all the relevant thermodynamic information contained in the interaction potentials for statistical mechanical systems. However, its explicit computation is usually a challenge for…
We provide upper and lower bounds on the lowest free energy of a classical system at given one-particle density $\rho(x)$. We study both the canonical and grand-canonical cases, assuming the particles interact with a pair potential which…
Using a Hubbard-Stratonovich transformation coupled with Fourier path integral methods, expressions are derived for the numerical evaluation of the microcanonical density of states for quantum particles obeying Boltzmann statistics. A…
In this brief note, the configurational density of states of a system of particles interacting via power-law pair potentials is computed exactly. The result is consistent with a constant microcanonical heat capacity. The well-known form of…
In the last years different studies have revealed the usefulness of a microcanonical analysis of finite systems when dealing with phase transitions. In this approach the quantities of interest are exclusively expressed as derivatives of the…
Recursion relations are presented that allow exact calculation of canonical and microcanonical partition functions of degenerate Fermi systems, assuming no explicit two-body interactions. Calculations of the level density, sorted by angular…
Semiclassical instanton theory is a form of quantum transition-state theory which can be applied to computing thermal reaction rates for complex molecular systems including quantum tunneling effects. There have been a number of attempts to…
We propose a new recursive procedure to estimate the microcanonical density of states in multicanonical Monte Carlo simulations which relies only on measurements of moments of the energy distribution, avoiding entirely the need for energy…
Multi-dimensional density of states provides a useful description of complex frustrated systems. Recent advances in Monte Carlo methods enable efficient calculation of the density of states and related quantities, which renew the interest…
We provide sufficient conditions for the solution of the classical inverse problem in the canonical distribution for multi-particle densities. Specifically, we show that there exists a unique potential in the form of a sum of m-particle (m…
The standard assumption for the equilibrium microcanonical state in quantum mechanics, that the system must be in one of the energy eigenstates, is weakened so as to allow superpositions of states. The weakened form of the microcanonical…
The harmonic chain is a classical many-particle system which can be solved exactly for arbitrary number of particles (at least in simple cases, such as equal masses and spring constants). A nice feature of the harmonic chain is that the…
We report a new multicanonical Monte Carlo algorithm to obtain the density of states for physical systems with continuous state variables in statistical mechanics. Our algorithm is able to obtain a closed-form expression for the density of…
We present a novel method for the calculation of the energy density of states D(E) for systems described by classical statistical mechanics. The method builds on an extension of a recently proposed strategy that allows the free energy…
The exact equations of motion for microscopic density of classical many-body system with account of inter-particle retarded interactions are derived. It is shown that interactions retardation leads to irreversible behaviour of many-body…
We set up a trace formula for the relativistic density of states in terms of a topological sum of classical periodic orbits. The result is applicable to any relativistic integrable system.
The preparation of many composites requires the intermixing of several macromolecular fluids along with the addition of solid filler particles. These fillers are usuallly polydisperse and there is an extensive experimental evidence that…