Terms Of Wave Functions Research Articles

Three-dimensional non-approximate Coulomb interaction between two trapped quantum particles

The two trapped quantum particles interacting problem is generalized to three dimensions, and the exact Coulomb potential is used. The system is solved by expanding the wavefunction in terms of the isotropic harmonic oscillator eigenfunctions and Hydrogen atom eigenfunctions independently, showing that each one results in a prime approximation for different domains of the normalized coupling constant of the relative interactions, suggesting that the combination of the basis is enough to build a well-suited base for the non-approximate problem. The results are compared to previous works that use a model of approximate finite-rage soft-core interaction model of the problem to give insights into the many-body states of strongly correlated ultracold bosons and fermions. We conclude that the proposed three-dimensional approach facilitates the distinction between bosons and fermions while the solutions given by the expansions better define the behavior of the particles for repulsive potentials. In addition, we discuss the substantial differences between our work and the previous approximate model.

Fast prescramblers

We consider the process of diffusion or "pre-scrambling" of information in a quantum system. We define a measure for this spreading or "pre-scrambling" of the wavefunction in terms of a minimum probability threshold for the states in the system's Hilbert space. We illustrate our findings on the example of a prototype model with enhanced memory capacity. We conjecture: (1) The fastest pre-scramblers require a time logarithmic in the number of degrees of freedom. (2) The investigated enhanced memory capacity model is a fast pre-scrambler. (3) (Fast) pre-scrambling occurs not later than (fast) scrambling. (4) Fast scramblers are fast pre-scramblers. (5) Black holes are fast pre-scramblers.

The Analytic Wavefunction

The wavefunction in quantum field theory is an invaluable tool for tackling a variety of problems, including probing the interior of Minkowski spacetime and modelling boundary observables in de Sitter spacetime. Here we study the analytic structure of wavefunction coefficients in Minkowski as a function of their kinematics. We introduce an off-shell wavefunction in terms of amputated time-ordered correlation functions and show that it is analytic in the complex energy plane except for possible singularities on the negative real axis. These singularities are determined to all loop orders by a simple energy-conservation condition. We confirm this picture by developing a Landau analysis of wavefunction loop integrals and corroborate our findings with several explicit calculations in scalar field theories. This analytic structure allows us to derive new UV/IR sum rules for the wavefunction that fix the coefficients in its low-energy expansion in terms of integrals of discontinuities in the corresponding UV-completion. In contrast to the analogous sum rules for scattering amplitudes, the wavefunction sum rules can also constrain total-derivative interactions. We explicitly verify these new relations at one-loop order in simple UV models of a light and a heavy scalar. Our results, which apply to both Lorentz invariant and boost-breaking theories, pave the way towards deriving wavefunction positivity bounds in flat and cosmological spacetimes.

Real energies and Berry phases in all PT-regimes in time-dependent non-Hermitian theories

We demonstrate that the existence of a Hermitian time-dependent intertwining operator that maps the non-Hermitian time-dependent energy operator to its Hermitian conjugate and its right to its left eigenstates guarantees the reality of the instantaneous energies. This property holds throughout all three -regimes, in the time-independent scenario referred to as the -symmetric regime, the exceptional point and the spontaneously broken -regime. We also propose a modified adiabatic approximation consisting of an expansion of the wavefunctions in terms the instantaneous eigenstates of the energy operator, instead of the usually used eigenfunctions of the Hamiltonian. We show that this proposal always leads to real Berry phases. We illustrate the working of our general proposals with two explicit examples for a time-dependent non-Hermitian spin model.

Solving the Schrödinger equation computationally using the Lanczos algorithm

The Schrödinger equation is a fundamental equation in quantum mechanics that describes the behavior of particles in terms of wave functions. These wave functions provide a probabilistic description of where the particle is likely to be found, making them a crucial tool for understanding how particles interact with their environment. Methods for solving the Schrödinger equation analytically tend to be very mathematically complex, leading us to look for other ways to solve the Schrödinger equation. Unfortunately, in most cases, the Schrödinger equation cannot be solved for an exact solution. There are methods, however, for approximate solutions. In this paper, we investigated the Lanczos algorithm, a computational method that can solve the 2D Schrödinger equation in cases where finding an analytical solution would not be feasible. We discretized the Schrödinger equation, then ran a Python program using the Lanczos algorithm to solve for the ground state wave function. We hypothesized that the Schrödinger equation could be solved computationally for the ground state wave function using the Lanczos algorithm. We found that this method efficiently solved the Schrödinger equation for complicated 2D potentials. Additionally, we verified the accuracy of the method by comparing the results with wave functions from problems with known, exact solutions.

The quantum trajectory‐guided adaptive Gaussian methodology in the Libra software package

AbstractIn this paper, we report an implementation of the quantum trajectory‐guided adaptive Gaussian (QTAG) method in a modular open‐source Libra package for quantum dynamics calculations. The QTAG method is based on a representation of wavefunctions in terms of a quantum trajectory‐guided adaptable Gaussians basis and is generalized for time‐propagation on multiple coupled surfaces to be applicable to model nonadiabatic dynamics. The potential matrix elements are evaluated within either the local harmonic or bra‐ket‐average (linear) approximations to the potential energy surfaces, the latter being a more practical option. Performance of the QTAG method is demonstrated and discussed for the Holstein and Tully models, which are the standard benchmarks for method development in the area of nonadiabatic dynamics.

A Study of Strong Confinement Regions Using Informational Entropy

We present an informational study of a spherically confined hydrogen atom, a hydrogenic ion confined in a strongly coupled plasma, a spherically confined harmonic oscillator, and a particle confined in a cage. For this, we have implemented a numerical procedure to obtain information entropies of these confined quantum systems. The procedure is based on the variational formalism that uses the finite element method (FEM) for the expansion of the wavefunction in terms of local base functions. Such a study is carried out in order to analyze what happens in the rigorous confinement regime. In particular, we have shown that the effects of the interaction potential is no longer important for rigorous confinements and the studied systems start to behave just like an electron confined by a impenetrable spherical cage. When possible, we compared our results with those published in the literature.

On the exactly-solvable semi-infinite quantum well of the non-rectangular step-harmonic profile

An exactly-solvable model of the non-relativistic harmonic oscillator with a position-dependent effective mass is constructed. The model behaves itself as a semi-infinite quantum well of the non-rectangular profile. Such a form of the profile looks like a step-harmonic potential as a consequence of the certain analytical dependence of the effective mass from the position and semiconfinement parameter $a$. Both states of the discrete and continuous spectrum are studied. In the case of the discrete spectrum, wavefunctions of the oscillator model are expressed through the Bessel polynomials. The discrete energy spectrum is non-equidistant and finite as a consequence of its dependence on parameter $a$, too. In the case of the continuous spectrum, wavefunctions of the oscillator model are expressed through the $_1F_1$ hypergeometric functions. At the limit, when the parameter $a$ goes to infinity, both wavefunctions, and the energy spectrum of the model under construction correctly reduce to corresponding results of the usual non-relativistic harmonic oscillator with a constant effective mass. Namely, wavefunctions of the discrete spectrum recover wavefunctions in terms of the Hermite polynomials, and wavefunctions of the continuous spectrum simply vanish. We also present a new limit relation that reduces Bessel polynomials directly to Hermite polynomials and prove its correctness using the mathematical induction technique.

Matrix product states and projected entangled pair states: Concepts, symmetries, theorems

The theory of entanglement provides a fundamentally new language for describing interactions and correlations in many body systems. Its vocabulary consists of qubits and entangled pairs, and the syntax is provided by tensor networks. We review how matrix product states and projected entangled pair states describe many-body wavefunctions in terms of local tensors. These tensors express how the entanglement is routed, act as a novel type of non-local order parameter, and we describe how their symmetries are reflections of the global entanglement patterns in the full system. We will discuss how tensor networks enable the construction of real-space renormalization group flows and fixed points, and examine the entanglement structure of states exhibiting topological quantum order. Finally, we provide a summary of the mathematical results of matrix product states and projected entangled pair states, highlighting the fundamental theorem of matrix product vectors and its applications.

Time evolution of ML-MCTDH wavefunctions. I. Gauge conditions, basis functions, and singularities

We derive a family of equations-of-motion (EOMs) for evolving multi-layer multiconfiguration time-dependent Hartree (ML-MCTDH) wavefunctions that, unlike the standard ML-MCTDH EOMs, never require the evaluation of the inverse of singular matrices. All members of this family of EOMs make use of alternative static gauge conditions than those used for standard ML-MCTDH. These alternative conditions result in an expansion of the wavefunction in terms of a set of potentially arbitrary orthonormal functions, rather than in terms of a set of non-orthonormal and potentially linearly dependent functions, as is the case for standard ML-MCTDH. We show that the EOMs used in the projector splitting integrator (PSI) and the invariant EOM approaches are two special cases of this family obtained from different choices for the dynamic gauge condition, with the invariant EOMs making use of a choice that introduces potentially unbounded operators into the EOMs. As a consequence, all arguments for the existence of parallelizable integration schemes for the invariant EOMs can also be applied to the PSI EOMs.

Dephasing versus collapse: lessons from the tight-binding model with noise

Condensed matter physics at room temperature usually assumes that electrons in conductors can be described as spatially narrow wave packets—in contrast to what the Schrödinger equation would predict. How a finite-temperature environment can localize wave functions is still being debated. Here, we represent the environment by a fluctuating potential and investigate different unravellings of the Lindblad equation that describes the one-dimensional tight-binding model in the presence of such a potential. While all unravellings show a fast loss of phase coherence, only part of them lead to narrow wave packets, among them the quantum-state diffusion unravelling. Surprisingly, the decrease of the wave packet width for the quantum state diffusion model with increasing noise strength is slower than that of the phase coherence length. In addition to presenting analytical and numerical results, we also provide phenomenological explanations for them. We conclude that as long as no feedback between the wave function and the environment is taken into account, there will be no unique description of an open quantum system in terms of wave functions. We consider this to be an obstacle to understanding the quantum-classical transition.

Neutron optics: New algorithm based on Green's functions for simulating waveguides with Dirichlet boundary conditions

We present a new, efficient and robust method for computing scalar wave propagation for those cases in which Dirichlet boundary conditions play a key role. The algorithm is versatile and it allows to treat reflection, diffraction, waveguiding regime, scattering and free propagation. The analysis is based upon a representation for a slow neutron wavefunction in terms of the incoming wave and integrals, along the boundaries of an unbounded domain, involving a Green's function and certain auxiliary functions (warranting the Dirichlet boundary conditions). The analysis involves Fourier and Hilbert transforms defined only on the boundaries and enables to exploit the detailed advantages of Fast Fourier Transform (FFT) to perform simulations. Our algorithm proves to be highly effective both in terms in running time and memory load, compared to those based on Finite Differences Methods (FDM). Moreover, since the value of the field at each point may be calculated independently, this algorithm allows parallelization in a natural way.

Towards communication in a curved spacetime geometry

The current race in quantum communication – endeavouring to establish a global quantum network – must account for special and general relativistic effects. The well-studied general relativistic effects include Shapiro time-delay, gravitational lensing, and frame dragging which all are due to how a mass distribution alters geodesics. Here, we report how the curvature of spacetime geometry affects the propagation of information carriers along an arbitrary geodesic. An explicit expression for the distortion onto the carrier wavefunction in terms of the Riemann curvature is obtained. Furthermore, we investigate this distortion for anti de Sitter and Schwarzschild geometries. For instance, the spacetime curvature causes a 0.10 radian phase-shift for communication between Earth and the International Space Station on a monochromatic laser beam and quadrupole astigmatism; can cause a 12.2% cross-talk between structured modes traversing through the solar system. Our finding shows that this gravitational distortion is significant, and it needs to be either pre- or post-corrected at the sender or receiver to retrieve the information.

Moments and saturation properties of eigenstates: Oscillator systems

Eigenvalues are defined for any element of an algebra of observables and do not require a representation in terms of wave functions or density matrices. A systematic algebraic derivation based on moments is presented here for the harmonic oscillator, together with a perturbative treatment of anharmonic systems. In this process, a collection of inequalities is uncovered which amount to uncertainty relations for higher-order moments saturated by the harmonic-oscillator excited states. Similar saturation properties hold for anharmonic systems order by order in perturbation theory. The new method, based on recurrence relations for moments of a state combined with positivity conditions, is therefore able to show new physical features.

Energy spectrum of massive Dirac particles in gapped graphene with Morse potential

In this paper, we study the massive Dirac equation with the presence of the Morse potential in polar coordinate. The Dirac Hamiltonian is written as two second-order differential equations in terms of two spinor wavefunctions. Since the motion of electrons in graphene is propagated like relativistic fermionic quasi-particles, then one is considered only with pseudospin symmetry for aligned spin and unaligned spin by arbitrary k. Next, we use the confluent Heun’s function for calculating the wavefunctions and the eigenvalues. Then, the corresponding energy spectrum obtains in terms of N and k. Afterward, we plot the graphs of the energy spectrum and the wavefunctions in terms of k and r, respectively. Moreover, we investigate the graphene band structure by a linear dispersion relation which creates an energy gap in the Dirac points called gapped graphene. Finally, we plot the graph of the valence and conduction bands in terms of wavevectors.

Exact variational dynamics of the multimode Bose-Hubbard model based on SU(M) coherent states

We propose a variational approach to the dynamics of the Bose-Hubbard model beyond the mean field approximation. To develop a numerical scheme, we use a discrete overcomplete set of Glauber coherent states and its connection to the generalized coherent states studied in depth by Perelomov [A. Perelomov, Generalized Coherent States and Their Applications, Springer-Verlag (Berlin, 1986)]. The variational equations of motion of the generalized coherent state parameters as well as of the coefficients in an expansion of the wavefunction in terms of those states are derived and solved for many-particle problems with large particle numbers S and increasing mode number M. For M = 6 it is revealed that the number of parameters that have to be propagated is more than one order of magnitude less than in an expansion in terms of Fock states.

Disorder-Free Localization in an Interacting 2D Lattice Gauge Theory.

Disorder-free localization has been recently introduced as a mechanism for ergodicity breaking in low-dimensional homogeneous lattice gauge theories caused by local constraints imposed by gauge invariance. We show that also genuinely interacting systems in two spatial dimensions can become nonergodic as a consequence of this mechanism. This result is all the more surprising since the conventional many-body localization is conjectured to be unstable in two dimensions; hence the gauge invariance represents an alternative robust localization mechanism surviving in higher dimensions in the presence of interactions. Specifically, we demonstrate nonergodic behavior in the quantum link model by obtaining a bound on the localization-delocalization transition through a classical correlated percolation problem implying a fragmentation of Hilbert space on the nonergodic side of the transition. We study the quantum dynamics in this system by introducing the method of "variational classical networks," an efficient and perturbatively controlled representation of the wave function in terms of a network of classical spins akin to artificial neural networks. We identify a distinguishing dynamical signature by studying the propagation of line defects, yielding different light cone structures in the localized and ergodic phases, respectively. The methods we introduce in this work can be applied to any lattice gauge theory with finite-dimensional local Hilbert spaces irrespective of spatial dimensionality.

Matrix product state recursion methods for computing spectral functions of strongly correlated quantum systems

We present a method for extrapolation of real-time dynamical correlation functions which can improve the capability of matrix product state methods to compute spectral functions. Unlike the widely used linear prediction method, which ignores the origin of the data being extrapolated, our recursion methods utilize a representation of the wavefunction in terms of an expansion of the same wavefunction and its translations at earlier times. This recursion method is exact for a noninteracting Fermi system. Surprisingly, the recursion method is also more robust than linear prediction at large interaction strength. We test this method on the Hubbard two-leg ladder and present more accurate results for the spectral function than previous studies.

Quantum particle motion on the surface of a helicoid in the presence of an harmonic oscillator

The geometric potential in quantum mechanics has been attracted attention recently, providing a formalism to investigate the influence of curvature in the context of low-dimensional systems. In this paper, we study the consequences of a helicoidal geometry in the Schrödinger equation dealing with an anisotropic mass tensor. In particular, we solve the problem of an harmonic oscillator in this scenario. For some specific conditions, we determine the wavefunction in terms of Confluent Heun Functions and compute the respective energy. The system exhibit several different behaviors, depending on the adjustment on the mass components.

Expansion of deformed harmonic oscillator wavefunctions in terms of spherical wavefunction bases: deformation effects

The interbasis expansion of deformed cylindrical 3D harmonic oscillator (HO) wavefunctions in terms of spherical wavefunction bases is introduced. The spatial overlap integral is rewritten in a simplified form and presented in terms of the axis ratio of the deformed nucleus. Deformed nuclear spheroidal shapes are considered, including both quadrupole and hexadecapole deformations. The effect of deformation on the oscillator lengths of deformed 3D-HO, and in turn on the spatial overlap coefficients, is discussed. For the description of the geometrical shape of deformed nuclear systems, the collective and extended Nilsson models for surface parametrization are used.