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International Conference on Computing Anticipatory Systems (CASYS)

Computational derivation of quantum and relativist systems with forward-backward space-time shifts

Daniel M. Dubois

Published Jan 1, 1999• 13 citations
Publisher

Abstract

This paper deals with computational derivation of the Klein-Gordon quantum relativist equation and the Schrödinger quantum equation with forward and backward space-time shifts. The first part introduces forward and backward derivatives for discrete and continuous systems. Generalized complex discrete and continuous derivatives are deduced. In the second part, we apply these forward and backward derivatives to the harmonic oscillator. The third part deduces the Klein-Gordon equation from the space-time complex continuous derivatives. These derivatives take into account forward-backward space-time shifts related to a phase velocity u. Without time shift, the Schrödinger equation is deduced in part four. This quantum equation is interpreted as a Burgers fluid with a complex momentum in relation to the Bohm-Hiley quantum potential concept. Finally a time-dependent Schrödinger equation for a free particle in a constant potential is simulated. The quantum particle looks like an oscillator with two frequencies.

DOI
10.1063/1.58252

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•May 19, 2010•0 citations
This paper deals with computational derivation of the Klein-Gordon quantum relativist equation and the Schrödinger quantum equation with forward and backward space-time shifts. The first part introduces forward and backward derivatives for discrete and continuous systems. Generalized complex discrete and continuous derivatives are deduced. In the second part, we apply these forward and backward derivatives to the harmonic oscillator. The third part deduces the Klein-Gordon equation from the space-time complex continuous derivatives. These derivatives take into account forward-backward space-time shifts related to a phase velocity u. Without time shift, the Schrödinger equation is deduced in part four. This quantum equation is interpreted as a Burgers fluid with a complex momentum in relation to the Bohm-Hiley quantum potential concept. Finally a time-dependent Schrödinger equation for a free particle in a constant potential is simulated. The quantum particle looks like an oscillator with two frequencies.
This paper is a continuation of our preceding paper dealing with computational derivation of the Klein–Gordon quantum relativist equation and the Schrödinger quantum equation with forward and backward space-time shifts. The first part introduces forward and backward derivatives for discrete and continuous systems. Generalized complex discrete and continuous derivatives are deduced. The second part deduces the Klein–Gordon equation from the space-time complex continuous derivatives. These derivatives take into account forward-backward space-time shifts related to an internal phase velocity u. The internal group velocity v is related to the speed of light u.v=c2 and to the external group and phase velocities u.v=vg.vp. Without time shift, the Schrödinger equation is deduced, with a supplementary term, which could represent a reference potential. The third part deduces the Quantum Relativist Klein–Gordon equation for a particle in an electromagnetic field.
Covariant classical particle dynamics is described, and the associated covariant relativistic particle quantum mechanics is derived. The invariant symmetric bracket is defined on the space of quantum amplitudes, and its relation to a generalized Hamiltonian dynamics and to a covariant Schrödinger type equation is shown. Examples for relativistic potential problems are solved. Mathematically and physically acceptable probability densities for the Klein-Gordon equation and for the Dirac equation are derived, and a new continuity equation for each case is given. The quantum distribution for mass is discussed, and unambiguous representations of four-velocity and four-acceleration operators are given.
Derivation of Klein–Gordon equation Goals and prior knowledge The main wave equations of relativistic quantum mechanics are the Klein–Gordon, Dirac, Weyl , and Rarita–Schwinger equations. The principal aim of this chapter is to derive these, by means of the EPI principles (3.16) and (3.18). The derivations generally follow Frieden (1995), or Frieden and Soffer (1995), with numerous additions. In addition, the Schrödinger wave equation (SWE), which is non -relativistic, is also to be derived. Since rigorous use of EPI gives only relativistic wave equations (Chapter 3), EPI can only derive the SWE in some approximate sense. This is directly carried through in Appendix D, or by taking the well-known non-relativistic limit of the Klein–Gordon equation in Appendix G. Also, in Appendix D a simple EPI derivation of classical mechanics is obtained. In particular, in the limit h → 0 the EPI extremum condition (3.16) is found to give Newton's second law , and the zero-condition (3.18) gives the virial theorem , of classical mechanics. Other derived results are Eq. (4.17) – the equivalence of mass, momentum, and energy; the constancy of the Planck constant h (Sec. 4.1.14); the Compton wavelength as an ultimate resolution length (Sec. 4.1.17); and the Heisenberg uncertainty principle (Sec. 4.3). It is important to state what is assumed a priori . The relativistic properties of space and time coordinates were derived in Sec. 3.5. Hence, these are assumed here. Also, appropriate units for the concepts of mass and energy are assumed to be known, although the basic relation Eq. (4.17) between them is not presumed.
In this study, both the Klein-Gordon equation and time-dependent Schrodinger equation are directly derived from De Broglie's (\lamda=h/p). Besides that, a new formula of the Klein-Gordon equation was obtained by using two equations, i.e., the classical wave function and relativistic total energy relation [[hw] = [(h^2 k^2)/2m] + V]. Moreover, a new equation of time-dependent Schrodinger (TDSE) in three-dimension 3D was derived and evidently obtained. Thus, the previous result corresponds to (TDSE) in 3D calculated using two equations, (i.e., Einstein energy and Newton's second law of mechanics).
Several theoretical methods for the computation of quantum dynamical quantities are formulated, implemented, and applied, in the overall context of overcoming the exponential scaling property of quantum mechanics. The convergence of the approximate forward-backward semiclassical dynamics (FBSD) method has been accelerated by working with only the imaginary part of the real-time position and momentum time correlation functions. Simple manipulations allow the computationally favorable limit of a single factorization (“bead”) of the Boltzmann operator to yield greatly improved results. Numerical examples for a one-dimensional anharmonic oscillator and Lennard-Jones fluids are presented. Bohm's trajectory formulation of quantum mechanics is an exact mapping of the time-dependent Schrödinger equation onto classical fluid dynamics, plus one extra term responsible for all non-classical effects, the dreaded quantum potential. A computational procedure has been introduced to stably solve Bohm's hydrodynamic equations of motion in the forward-backward quantum dynamics (FBQD) formulation of time correlation functions, and applied to one-dimensional bound systems at zero and low temperature. A key step in the formulation of this procedure was the use of Hamilton's law of varying action, a generalization of Hamilton's principle of stationary action applicable to initial-value problems. This has resulted in the first reported synthetic computation of non-stationary quantum trajectories for a fully anharmonic oscillator. Success in one dimension has laid the groundwork for future extension to a rigorous quantum-classical scheme, which is briefly discussed. Other unpublished methods for obtaining time correlation functions and propagators in quantum dynamics are also discussed.