Related papers: Orbital-Free Quasi-Density Functional Theory
Wigner phase space quasi-probability distribution function is a Fourier transform related to a given quantum mechanical wave function. It is shown that for the wave functions of type $\psi (q)=e^{-aq^2}\phi (q)$, the Wigner function can be…
Using linear invariant operators in a constructive way we find the most general thermal density operator and Wigner function for time-dependent generalized oscillators. The general Wigner function has five free parameters and describes the…
We develop a semiclassical approximation for the spectral Wigner and Husimi functions in the neighbourhood of a classically unstable periodic orbit of chaotic two dimensional maps. The prediction of hyperbolic fringes for the Wigner…
For an ergodic system, the time average of a classical observable coincides with that obtained via the Liouville probability density, a delta-function on the energy shell. Reinterpreting this distribution as a Wigner function, that is, the…
Wigner functions provide a way to do quantum physics using quasiprobabilities, that is, "probability" distributions that can go negative. Informationally complete POVMs, a much younger subject than phase space formulations of quantum…
This letter aims to derive the exact relativistic orbital-free kinetic energy density functional for one-particle nuclear systems in one-dimensional case. The kinetic energy is expressed as a functional of both vector and scalar densities.…
Following a general method proposed earlier, we construct here Wigner functions defined on coadjoint orbits of a class of semidirect product groups. The groups in question are such that their unitary duals consist purely of representations…
Traditional theories of electron transport in crystals are based on the Boltzmann equation and do not capture physics arising from quantum coherence. We introduce a transport formalism based on ''orbital Wigner functions'', which accurately…
The integral of the Wigner function over a subregion of the phase-space of a quantum system may be less than zero or greater than one. It is shown that for systems with one degree of freedom, the problem of determining the best possible…
Polymer self-consistent field theory techniques are used to derive quantum density functional theory without the use of the theorems of density functional theory. Instead, a free energy is obtained from a partition function that is…
The Wigner function, which provides a phase-space description of quantum systems, has various applications in quantum mechanics, quantum kinetic theory, quantum optics, radiation transport and others. The concept of Wigner function has been…
We estimate the quantum state of a light beam from results of quantum homodyne measurements performed on identically prepared pulses. The state is represented through the Wigner function, a ``quasi-probability density'' on $\mathbb{R}^{2}$…
To advance the foundation of one-particle reduced density matrix functional theory (1RDMFT) we refine and relate some of its fundamental features and underlying concepts. We define by concise means the scope of a 1RDMFT, identify its…
In this article we introduce a quasiprobability distribution of work that is based on the Wigner function. This construction rests on the idea that the work done on an isolated system can be coherently measured by coupling the system to a…
A discussion of discrete Wigner functions in phase space related to mutually unbiased bases is presented. This approach requires mathematical assumptions which limits it to systems with density matrices defined on complex Hilbert spaces of…
We study the Wigner function for a quantum system with a discrete, infinite dimensional Hilbert space, such as a spinless particle moving on a one dimensional infinite lattice. We discuss the peculiarities of this scenario and of the…
Orbital-free density functional theory promises to deliver linear-scaling electronic structure calculations. This requires the knowledge of the non-interacting kinetic-energy density functional (KEDF), which should be accurate and must…
A quasi-particle theory for monatomic gases in equilibrium is formulated and evaluated to yield the exact virial contributions to the thermodynamic state functions in lowest order of the density. Van der Waals blocking has necessarily to be…
The route to reliable quantum nanoelectronic devices hinges on precise control of the electrostatic environment. For this reason, accurate methods for electrostatic simulations are essential in the design process. The most widespread…
A fermion ground state energy functional is set up in terms of particle density, relative pair density, and kinetic energy tensor density. It satisfies a minimum principle if constrained by a complete set of compatibility conditions. A…