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Stability and convergence of the space fractional variable-order Schrödinger equation
Advances in Difference Equations volume 2013, Article number: 80 (2013)
The space fractional Schrödinger equation was further extended to the concept of space fractional variable-order derivative. The generalized equation is very difficult to handle analytically. We solved the generalized equation numerically via the Crank-Nicholson scheme. The stability and the convergence of the space fractional variable-order Schrödinger equation were presented in detail.
In quantum mechanics, the Schrödinger equation is a partial differential equation that describes how the quantum state of some physical system changes with time. It was formulated in late 1925, and published in 1926, by the Austrian physicist Erwin Schrödinger. Fractional-order derivatives can be dated back to the seventeenth century . It has primarily developed as a pure notional field of mathematics since its appearance. However, fractional-order differential systems have been proved to be useful in physics, engineering and even financial analysis in the last few decades . The fractional-order dynamical systems consist of viscoelastic systems , dielectric polarization , electrode-electrolyte polarization , electromagnetic waves , quantitative finance  and quantum evolution of complex systems . In particular, in fractional quantum evolution fields, there are many results obtained by some scholars (see in [8–17]). For instance, Laskin put up the space fractional quantum mechanics in 2000 [9–12], and the Schrödinger equation with space fractional derivative was also studied [13–16]. In the same way, the time fractional Schrödinger equation was also discussed in the works [15–17]. However, many researchers in the field of mathematics and physics paid attention to study physical problems described by the variable order derivative (see [18–22]). As a result of important differences between fractional order differential equations (FODE) and variable-order differential equations (VFODE), most characteristics or conclusions of the FODE systems can sometimes be extended to the case of the VFODE systems. Recently, many efforts have been devoted to the study of chaotic dynamics of variable-order differential systems [23–28]. Many current results about variable-order chaotic systems, however, are accomplished only by numerical simulations. In this work we further investigate the possibility of extension of the fractional Schrödinger equation to the concept of variable-order time fractional. The stability and the convergence of the new equation will be investigated in detail.
2 Problem formulation
For the readers that are not acquainted with the concept of the variable-order derivative, we start this section and we present the basic definition of this derivative.
2.1 Variable-order differential operator
Let , denote a continuous and necessary differentiable, let be a continuous function in . Then its variation-order differential is defined as:
The above derivative is called the Caputo variable-order differential operator; in addition, the derivative of the constant is zero.
2.2 Modification of the Schrödinger equation
The most famous example is the nonrelativistic Schrödinger equation for a single particle moving in an electric field as given below
where m is the particle’s mass, V is its potential energy, is the Laplacian, and Ψ is the wave-function, more precisely, in this context, it is called the position-space wave-function. In plain language, it means total energy equals kinetic energy plus potential energy. The Schrödinger equation plays the role of Newton’s law and conservation of energy in classical mechanics meaning it predicts the future behavior of a dynamic system. It is a wave equation in terms of the wave-function, which predicts analytically and precisely the probability of events or outcome. The detailed outcome is not strictly determined, but given a large number of events, the Schrödinger equation will predict the distribution of results. The kinetic and potential energies are transformed into the Hamiltonian which acts upon the wave-function to generate the evolution of the wave-function in time and space. The Schrödinger equation gives the quantized energies of the system and gives the form of the wave-function so that other properties may be calculated. This equation was extended to the concept of fractional order derivative with great success (see [15–17]). In this paper we extend this equation to the concept of fractional variable-order derivative by replacing the Laplace operator in Equation (2.1) by the variable-order Laplace operator to obtain:
The above equation will be called the space fractional variable-order Schrödinger equation. This modified equation cannot be solved analytically, therefore, in the following section we present, the discussion underpinning the numerical solution via the Crank-Nicholson scheme.
3 Numerical solution of the modified equation
Environmental phenomena, such as space fractional variable-order Schrödinger equation, are highly complex phenomena, which do not lend themselves readily to analysis of analytical models. The discussion presented in this section will therefore be devoted to the derivation of numerical solution to the space fractional variable-order Schrödinger equation (2.3).
Numerical methods yield approximate solutions to the governing equation through the discretization of space and time. Within the discretized problem domain, the variable internal properties, boundaries, and stresses of the system are approximated. Deterministic, distributed-parameter, numerical models can relax the rigid idealized conditions of analytical models or lumped-parameter models, and they can therefore be more realistic and flexible for simulating fields conditions. The finite difference schemes for constant-order time or space fractional diffusion equations have been extensively considered in the literature; see, for instance, the work done in [14–19]. For constant-order time fractional diffusion equations, an implicit difference approximation scheme was presented in . The weighted average finite difference method was initiated in . Podlubny proposed the matrix approach for fractional diffusion equations  and Hanert proposed a flexible numerical scheme for the discretization of the space-time fractional diffusion equation . Recently, Zhuang well thought out the numerical schemes for the variable-order (VO) space fractional advection-dispersion equation . Lin studied the explicit scheme for the VO nonlinear space fractional diffusion equation . Recently, Atangana and Botha presented the stability and the convergence of the generalized time-fractional variable-order groundwater flow equation .
3.1 Crank-Nicholson scheme
Before performing the numerical methods, we assume Equation (2.3) has a unique and sufficiently smooth solution. To establish the numerical schemes for the above equation, we let , , , , , , h is the step and τ is the time size, M and N are grid points.
We introduce the Crank-Nicholson scheme as follows. Firstly, the discretization of first and second-order space derivative is stated as
The Crank-Nicholson scheme for the VO space fractional Schrödinger equation can be stated as follows:
It is important to point out that the quadrature formula (3.3) does not provide the values of the time fractional derivative at which are not required by the implicit finite difference and the Crank-Nicholson method schemes that follow.
Now, the Crank-Nicholson method with the discrete formulas (3.1), (3.2) and (3.4) is used to estimate the space variable-order fractional derivative to solve numerically the VO space fractional Schrödinger equation (2.3). If the potential is bounded from below, meaning there is a minimum value of potential energy, the eigen-functions of the Schrödinger equation have energy, which is also bounded from below. This can be seen most easily by using the variational principle. For simplicity, we assume that the potential energy V has upper and lower boundaries, and we consider its average value in this paper. Using (3.1), (3.2) and (3.3) the restriction of the exact solution to the grid points centred at ; in Equation (2.3), satisfies for :
where is the truncation term. Thus, according to Equation (3.4), the numerical method is consistent, first order correct in time and second order correct in space.
Now, for simplicity, we let such that, the resulting finite difference equations are defined by
Substituting (3.6) into (3.5) and reordering, we obtained the following:
With the inclusion of the boundary conditions: , . It is important to note that, Equation (3.7) requires, at each time step, to solve a tri-diagonal system of linear equations where the right-hand side utilizes all the history of the computed solution up to that time.
Our next concern here is to show that the stability of the fractional numerical schemes can be analyzed very successfully with no trouble and powerfully with the distinguished Von Neumann method of non-fractional partial differential equations .
4 Stability analysis of space fractional variable-order Schrödinger equation
In this section, we will analyze the stability conditions of the Crank-Nicholson scheme for the space fractional variable-order Schrödinger equation.
Let , here is the approximate solution at the point (, ) and in addition and the function is chosen to be:
Then, the function can be expressed in Fourier series as follows:
It was established by  that
Observe that for all , . In addition, according to the problem under investigation, the Planck constant h, m the particle’s mass and V its potential energy are positive constants. Then the following properties of the coefficients , , and can be established:
Note that in this case, the error committed while approximating the solution of the space fractional variable-order Schrödinger equation with the Crank-Nicholson scheme can be presented as follows:
If we assume that: in Equation (4.11) can be put in the delta-exponential form as follows:
where φ is a real spatial wave number, new replacing the above Equation (4.6) in (4.5) we obtain the following expression:
We next show that, for all the solution of Equation (4.7) complies with the following condition:
To achieve this, we make use of the recurrence technique on the natural number k.
For and , are positive for all , then we obtain:
The condition is true for .
Assuming that for the property is verified. Then
Using the triangular inequality we obtain:
and the proof is completed.
5 Convergence analysis of space fractional variable-order Schrödinger equation
Assuming that, (, ) is the exact solution of our problem at the point , by letting and substituting this in Equation (4.5), we obtain:
From Equations (3.1) and (3.2) we have the following:
From the above we have that:
Lemma 1 is true for where , K is a constant. In addition,
This can be achieved via the recurrence technique on the natural number k. When , we have the following:
Now suppose that , . Then
Using the recurrence hypothesis, the above equation is reduced to the following expression:
and the proof is completed.
Theorem 1 The Crank-Nicholson scheme of the space fractional variable-order Schrödinger equation is convergent, and there exists a positive constant K such that:
An interested reader can find the solvability of the Crank-Nicholson scheme in the work done in . Therefore, the details of the proof will not be presented in this paper.
We paid attention to study a possible generalization of the Schrödinger equation to the concept of space fractional variable-order derivative. The Laplace operator in the Schrödinger equation was replaced by the fractional variable Laplace operator. Since the new equation cannot be solved analytically, it was solved numerically via the Crank-Nicholson technique.
We presented in detail the stability and the convergence of this problem.
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Authors would like to thank the editor for his valuable time spared to access this manuscript and for his valuable comments toward the enhancement of this paper. Also, the authors would like to thank the anonymous referee for their valuable comments and suggestions toward the enhancement of this manuscript.
The authors declare that they have no competing interests.
AA wrote the first draft and AHC corrected and improved the final version. All authors read and approved the final draft.
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Atangana, A., Cloot, A.H. Stability and convergence of the space fractional variable-order Schrödinger equation. Adv Differ Equ 2013, 80 (2013) doi:10.1186/1687-1847-2013-80
- Schrödinger equation
- variable-order derivative
- Crank-Nicholson scheme