Related papers: A gradient flow model for ground state calculation…
In this paper, the ground state Wigner function of a many-body system is explored theoretically and numerically. First, an eigenvalue problem for Wigner function is derived based on the energy operator of the system. The validity of finding…
Non-classical states are of practical interest in quantum computing and quantum metrology. These states can be detected through their Wigner function negativity in some regions. In this paper, we calculate the ground state of the…
This work focuses on the numerical computation of defocusing action ground states for rotating nonlinear Schr\"odinger equations (RNLS) using a direct gradient flow (DGF) method. We address theoretical gaps in the existing literature…
Density matrices and Discrete Wigner Functions are equally valid representations of multiqubit quantum states. For density matrices, the partial trace operation is used to obtain the quantum state of subsystems, but an analogous…
The deformation quantization formalism is applied to the linearized gravitational field. Standard aspects of this formalism are worked out before the ground state Wigner functional is obtained. Finally, the propagator for the graviton is…
The original Wigner function provides a way of representing in phase space the quantum states of systems with continuous degrees of freedom. Wigner functions have also been developed for discrete quantum systems, one popular version being…
We present GW many-body results for ground-state properties of two simple but very distinct families of inhomogenous systems in which traditional implementations of density-functional theory (DFT) fail drastically. The GW approach gives…
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…
A new iterative solver is proposed to efficiently calculate the ground state electronic structure in Density Functional Theory calculations. This algorithm is particularly useful for simulating physical systems considered difficult to…
We introduce and implement a method to compute stationary states of nonlinear Schr\''odinger equations on metric graphs. Stationary states are obtained as local minimizers of the nonlinear Schr\''odinger energy at fixed mass. Our method is…
Density-functional theory is a formally exact description of a many-body quantum system in terms of its density; in practice, however, approximations to the universal density functional are required. In this work, a model based on deep…
We describe how density-functional theory, well-known for its many uses in ab initio calculations of electronic structure, can be used to study the ground state of inhomogeneous model Hamiltonians. The basic ideas and concepts are discussed…
The Wigner function of quantum systems is an effective instrument to construct the approximate classical description of the systems for which the classical approximation is possible. During the last time, the Wigner function formalism is…
Electron transport properties in nanostructures can be modeled, for example, by using the semiclassical Wigner formalism or the quantum mechanical Green's functions formalism. We compare the performance and the results of these methods in…
In this paper, we generalize the normalized gradient flow method which was first applied to computing the least energy ground state to compute the least action ground state. A continuous normalized gradient flow (CNGF) will be presented and…
The Wigner function is a useful tool for exploring the transition between quantum and classical dynamics, as well as the behavior of quantum chaotic systems. Evolving the Wigner function for open systems has proved challenging however; a…
Predicting molecular ground-state conformation (i.e., energy-minimized conformation) is crucial for many chemical applications such as molecular docking and property prediction. Classic energy-based simulation is time-consuming when solving…
The Wigner function for one and two-mode quantum systems is explicitely expressed in terms of the marginal distribution for the generic linearly transformed quadratures. Then, also the density operator of those systems is written in terms…
We develop a fast and scalable numerical approach to solve Wasserstein gradient flows (WGFs), particularly suitable for high-dimensional cases. Our approach is to use general reduced-order models, like deep neural networks, to parameterize…
We present a Wigner function-based approach for the particle density evolution in fermionic and bosonic open quantum many-body systems, including the effects of dephasing. In particular, we focus on chains of non-interacting particles…