相关论文: A Practical Guide to the Partition Function of Ato…

We devise a hierarchy of computational algorithms to enumerate the microstates of a system comprising N independent, distinguishable particles. An important challenge is to cope with integers that increase exponentially with system size,…

Define a "nuclear partition" to be an integer partition with no part equal to one. In this study we prove a simple formula to compute the partition function $p(n)$ by counting only the nuclear partitions of $n$, a vanishingly small subset…

Efficient characterization of highly entangled multi-particle systems is an outstanding challenge in quantum science. Recent developments have shown that a modest number of randomized measurements suffices to learn many properties of a…

Exact and approximate expressions for thermodynamic characteristics of heated matter, which consists of particles with finite mass-widths, are constructed. They are expressed in terms of Fermi/Bose distributions and spectral functions,…

By performing an ensemble of molecular dynamics simulations, the model-dependent ionisation state is computed for strongly interacting systems self-consistently. This is accomplished through a free energy minimisation framework based on the…

We describe a procedure to solve an up to $2N$ problem where the particles are separated topologically in $N$ groups with at most two particles in each. Arbitrary interactions are allowed between the (two) particles within one group. All…

The number-theoretical problem of partition of an integer corresponds to $D=2$. This problem obeys the Bose--Eeinstein statistics, where repeated terms are admissible in the partition, and to the Fermi--Dirac statistics, where they are…

The partition function and free energy of a quantum many-body system determine its physical properties in thermal equilibrium. Here we study the computational complexity of approximating these quantities for $n$-qubit local Hamiltonians.…

Heavy ion collisions, produced in particle accelerators, lead to the formation of a new state of matter, known as the quark gluon plasma. It is not possible to observe directly the plasma, where quarks and gluons are not confined into…

In this work, we present a compact analytical approximation for the quantum partition function of systems composed of quantum oscillators. The proposed formula is general and applicable to an arbitrary number of oscillators described by a…

Conceiving a molecule as composed of smaller molecular fragments, or subunits, is one of the pillars of the chemical and physical sciences, and leads to productive methods in quantum chemistry. Using a fragmentation scheme, efficient…

We study the thermodynamics of various physical systems in the framework of the Generalized Uncertainty Principle that implies a minimal length uncertainty proportional to the Planck length. We present a general scheme to analytically…

H3+ and the deuterated isotopomers are thought to play an important role in interstellar chemistry. The partition functions of H3+, D2H+ and D3+ are calculated to a temperature of 800 K by explicitly summing the ab initio determined…

Radiative cooling is an important ingredient in hydrodynamical models involving evolution of high temperature plasmas. Unfortunately, calculating an accurate cooling coefficient generally requires the solution of over a hundred differential…

We give an expression for the partition function of a one-dimensional log-gas comprised of particles of (possibly) different integer charge at inverse temperature {\beta} = 1 (restricted to the line in the presence of a neutralizing field)…

To simulate indistinguishable particles, recent studies of path-integral molecular dynamics formulated their partition function $Z$ as a recurrence relation involving a variable $\xi$, with $\xi=1$(-1) for bosons (fermions). Inspired by…

Equations are obtained for the quantum distribution functions over discrete states in systems of non-interacting fermions and bosons with an arbitrary, including small, number of particles. The case of systems with two levels is considered…

We present calculations of frequency-dependent complex dielectric function of dense aluminum plasma by quantum molecular dynamics method for temperatures up to 20 kK. Analysis shows that the dependencies for real and imaginary parts can be…

We consider a simple model of the dynamics of a single electron in a crystal lattice. Although this is a standard problem in condensed matter physics, alternative ways of evaluating a partition function for such a system lead to equalities,…

Recent investigations show that the statistical mechanics of a finite number of particles in ideal harmonic systems predicts different results for the same physical properties, depending on the ensemble under consideration. Path integral…