Related papers: Geometric Phase Effect in Thermodynamic Properties…
Oscillatory rarefied gas flows are frequently encountered in MEMS, and their efficient numerical simulation remains a major challenge due to the time dependent nature of the problem and the high dimensionality of the Boltzmann kinetic…
Mean-field molecular dynamics based on path integrals is used to approximate canonical quantum observables for particle systems consisting of nuclei and electrons. A computational bottleneck is the sampling from the Gibbs density of the…
We discuss physical properties of `integer' topological phases of bosons in D=3+1 dimensions, protected by internal symmetries like time reversal and/or charge conservation. These phases invoke interactions in a fundamental way but do not…
Quantum phase transition is one of the main interests in the field of condensed matter physics, while geometric phase is a fundamental concept and has attracted considerable interest in the field of quantum mechanics. However, no relevant…
Topology in quantum matter is typically associated with gapped phases. For example, in symmetry protected topological (SPT) phases, the bulk energy gap localizes edge modes near the boundary. In this work we identify a new mechanism that…
Quantum reactive scattering calculations are reported for the ultracold hydrogen-exchange reaction and its non-reactive atom-exchange isotopic counterparts, proceeding from excited rotational states. It is shown that while the geometric…
Recently, fictitious identical particles have provided a promising way to overcome the fermion sign problem and have been used in path integral Monte Carlo (PIMC) to accurately simulate warm dense matter with up to 1000 electrons (T.…
We present the fundamentals of geometrothermodynamics, an approach to study the properties of thermodynamic systems in terms of differential geometric concepts. It is based, on the one hand, upon the well-known contact structure of the…
Geometric phases in particle diffusion systems, an intriguing aspect enlightened from thermal systems, offer a different understanding beyond traditional Brownian motion and Fick's laws. This concept introduces a phase factor with…
Tailoring energy levels in quantum systems via Hamiltonian control parameters is essential for designing quantum thermodynamic devices and materials. However, conventional methods for manipulating finite-size systems, such as tuning…
We illustrate how geometric gauge forces and topological phase effects emerge in quantum systems without employing assumptions that rely on adiabaticity. We show how geometric magnetism may be harnessed to engineer novel quantum devices…
In this paper we present a Path Integral Monte Carlo (PIMC) simulation of the orthorhombic phase of crystalline polyethylene, using an explicit atom force field with unconstrained bond lengths and angles. This work represents a quantum…
We explore the performance of a statistical learning technique based on Gaussian Process (GP) regression as an efficient non-parametric method for constructing multi-dimensional potential energy surfaces (PES) for polyatomic molecules.…
The uniform electron gas (UEG) at finite temperature is of high current interest due to its key relevance for many applications including dense plasmas and laser excited solids. In particular, density functional theory heavily relies on…
We perform calculations of the {3D} finite-temperature homogeneous electron gas (HEG) in the warm-dense regime ({r_{s} \equiv (3/4\pi n)^{1/3}a_{B}^{- 1} = 1.0- 40.0} and {\Theta \equiv T/T_{F} = 0.0625- 8.0}) using restricted path integral…
Using the Bethe ansatz solution, we analytically study expansionary, magnetic and interacting Gr\"uneisen parameters (GPs) for one-dimensional (1D) Lieb-Liniger and Yang-Gaudin models. These different GPs elegantly quantify the dependences…
We consider an atom (represented by a two-level system) moving in front of a dielectric plate, and study how traces of dissipation and decoherence (both effects induced by vacuum field fluctuations) can be found in the corrections to the…
Geometric measure of entanglement and geometric phase have recently been used to analyze quantum phase transition in the XY spin chain. We unify these two approaches by showing that the geometric entanglement and the geometric phase are…
The use of variational method in functional integral approach is discussed for fermion and boson systems with Coulomb interaction. The formal general expression of thermodynamic potential is obtained by Feynman path integral technique and…
This paper contains a fully geometric formulation of the General Equation for Non-Equilibrium Reversible-Irreversible Coupling (GENERIC). Although GENERIC, which is the sum of Hamiltonian mechanics and gradient dynamics, is a framework…