OFFPRINT Anomalous diffusion and semimartingales A. Weron and M. Magdziarz EPL, 86 (2009) 60010 Please visit the new website www.epljournal.org TAKE A LOOK AT THE NEW EPL Europhysics Letters (EPL) has a new online home at www.epljournal.org Take a look for the latest journal news and information on: • reading the latest articles, free! • receiving free e-mail alerts • submitting your work to EPL www.epl journal.org June 2009 EPL, 86 (2009) 60010 doi: 10.1209/0295-5075/86/60010 www.epljournal.org Anomalous diffusion and semimartingales A. Weron and M. Magdziarz(a) Hugo Steinhaus Center, Institute of Mathematics and Computer Science, Wroclaw University of Technology Wyspianskiego 27, 50-370 Wroclaw, Poland, EU received 27 February 2009; accepted in final form 5 June 2009 published online 10 July 2009 PACS PACS PACS 05.40.Fb – Random walks and Levy flights 02.50.Ey – Stochastic processes 05.10.-a – Computational methods in statistical physics and nonlinear dynamics Abstract – We argue that the essential part of the currently explored models of anomalous (non-Brownian) diffusion are actually Brownian motion subordinated by the appropriate random time. Thus, in many cases, anomalous diffusion can be embedded in Brownian diffusion. Such an embedding takes place if and only if the anomalous diffusion is a semimartingale process. We also discuss the structure of anomalous diffusion models. Categorization of semimartingales can be applied to differentiate among various anomalous processes. In particular, identification of the type of subdiffusive dynamics from experimental data is feasible. c EPLA, 2009 Copyright Introduction. – The beginning of the long-lasting marriage of Brownian motion with physics dates back to two breakthrough papers [1,2], in which both authors Einstein and Smoluchowski explained independently the phenomenon of Brownian motion as a result of collisions between the suspended particles and the molecules of the surrounding fluid. A different and innovative approach was proposed by Langevin [3]. Even earlier, in 1900, Bachelier [4] bound up Brownian motion with financial modeling, by introducing the first model of stock price at the Paris Bourse. However, in spite of many obvious advantages, models based on Brownian motion fail to provide satisfactory description of many dynamical processes [5–7]. The detailed empirical analysis of various complex systems shows that some of the significant properties of such systems cannot be captured by the Brownian diffusion models. One should mention here such properties as: nonlinear in time mean-squared displacement, long-range correlations, nonexponential relaxation, heavy-tailed and skewed marginal distributions, lack of scale invariance, discontinuity of the trajectories, and many others [8]. To capture such anomalous properties of physical systems, some different mathematical models need to be introduced. In recent years one observes a rapid evolution in this direction, which results in emerging of various alternative models, such as: continuous-time random walks [9], fractional kinetic equations [8,10,11], fractional (a) E-mail: [email protected] Brownian motions [12,13], generalized Langevin equations [14], jump-diffusion models [15], subordinated Langevin equations [16,17], etc. The increasing accuracy of the empirical measurements reveals different anomalous properties of the systems, which cannot be satisfactorily described by the models based on Brownian diffusion. As we will show in the following, Brownian motion is doing well also in the world of anomalous (non-Brownian) diffusion [18]. It turns out that the large part of the currently explored models of anomalous transport can be represented as Brownian motion but in the appropriate internal clock of the system. Semimartingales. – We will start with an observation that anomalous diffusion processes are in a very close relation with the so-called semimartingales. The concept of semimartingales became popular in the 1970s, see the basic papers by Föllmer [19], Bichteler [20,21], and Dellacherie [22]. However, it was introduced earlier by Meyer [23]. The stochastic integration with respect to semimartingales was developed by him and his collaborators. Since then their mathematical theory attracted a considerable attention and has found already important applications to asset pricing in economy [15]. A semimartingale Xt uniquely decomposes as Xt = Mt + At , (1) where Mt is a local martingale (its increment process is a fair-game, meaning that the expectation value of increments is zero), and At is a finite variation process, 60010-p1 A. Weron and M. Magdziarz which can be considered as the drift part of Xt [24]. Thus, the most relevant subclass of semimartingales constitute martingales. The concept of a martingale is the stochastic analog of a conserved quantity. A process Mt is said to be a martingale if it has the property that the (future) conditional mean value is equal to the last value specified by the condition, i.e. Mt |Mtn , . . . , Mt1 = Mtn , t > tn > . . . > t1 . In other words, Mt is a martingale if its conditional expectation, given information up to time tn , is the value of the process at that time. Thus, in a certain sense, martingales are the stochastic analog of conservation laws: expectation is conserved. The concept of martingale can also be used effectively to characterize the reductive properties of energy-based stochastic extension of the Schrödinger equation [25]. For the martingale description of physical fluctuations see [26]. Also, the time operator in the Prigogine theory of irreversibility can be constructed as an integral with respect to martingales [27]. The martingale property has found widespread applications in finance and game theory, since it formalizes the concept of the fairness of the game. Let us mention some well-known examples of martingales: the position process of the classical random walker, being the the sum of fair-game increments, is a martingale. Similarly, Brownian diffusion without drift is a martingale. However, the Brownian diffusion with a drift dXt = σ(Xt , t) dBt + µ(Xt , t) dt is only a semimartingale illustrating the decomposition (1). Many significant processes, including Brownian motion, Poisson process, Lévy processes, are semimartingales. Nevertheless, it is not always the case. An example of the process, which does not belong to this class is the fractional Brownian motion [12,13], as well as the fractional α-stable motion [28] ∞ H−1/α H−1/α dLα (u). (t − u)+ − (−u)+ −∞ Semimartingales are the most general reasonable stochastic integrators, for which the pathwise evaluation of stochastic Itô-type integrals is possible [20,21]. The class of semimartingales is invariant under smooth transformation (Itô lemma), random change of time and Itô stochastic integration. Thanks to these plausible properties, semimartingales have found widespread applications and play a fundamental role in stochastic modelling including for example modern modelling of financial data [15,29]. We will demonstrate in this letter that, the role of semimartingales in the description of anomalous diffusion is significant as well. The large part of well-known anomalous diffusion processes can be represented as time-changed Brownian motion. Thus, by employing the I. Monroe result [30], every time-changed Brownian motion is a semimartingale. In other words, we obtain the following interpretation of Monroe’s result in the context of anomalous dynamics —the Embedding Principle for anomalous diffusion: Anomalous diffusion process can be represented as time-changed Brownian motion if and only if it is a semimartingale. The above statement confirms the intimate relation between semimartingales and anomalous transport. Since the mathematical theory of semimartingales is well developed, it can help to identify and understand better various properties of anomalous diffusions. The quantity called the quadratic variation is of particular interest from the point of view of applications of semimartingales in physics. Let X(t) be a stochastic process observed on time interval [0, T ]. Then, for t ∈ [0, T ], the quadratic variation V (2) (t) corresponding to X(t) is defined as V (2) (t) = lim Vn(2) (t), n→∞ (2) (2) where Vn (t) is the partial sum of the squares of increments of the process X(t) given by Vn(2) (t) = n 2 −1 j=0 X 2 (j + 1)T jT ∧ t − X ∧ t n n 2 2 (3) with a ∧ b = min{a, b}. The crucial property of the trajectories of semimartingales is the fact that their quadratic variation is always finite. This is not the case for any stochastic process in general. For example, quadratic variation of fractional Brownian motion (FBM) BH (t) with Hurst index H less than 1/2, is infinite. This follows from the fact that FBM is H–self-similar and its increments 2 satisfy (BH (t + h) − BH (t))2 ∼ h2H BH (1). Since 2H < 1, the sum of the squares of the increments in (3) diverges to infinity as n → ∞. Similar reasoning can be applied to diffusion on fractal, which is yet another example of process with infinite quadratic variation and does not belong to the class of semimartingales. The dissimilarities in the behavior of quadratic variation provide a simple way how to distinguish between different kinds of subdiffusion (CTRW, FBM, diffusion in confined media) from experimental data [31]. One only needs to examine the behavior of the quadratic variation of a given trajectory. Detection of the type of anomaly is an important and timely problem, see for example [32–34] for discussion on the origins of anomaly in the case of intracellular diffusion. Thus, the information that a given physical process belongs to the family of semimartingales, gives an important additional gain in understanding the behavior of the trajectories. This can be used to identify the type of anomaly from experimental data [31]. Moreover, representation of a given stochastic process as time-changed Brownian motion allows to run efficient Monte Carlo simulations of its trajectories and to perform numerical analysis of sample paths [35]. Next, to illustrate the embedding principle, we will consider in details several physically relevant special cases 60010-p2 Anomalous diffusion and semimartingales 50 1 B(Uα(t)) S (t) α U (t) 0 −1 −2 0 25 25 t 50 25 t 50 4 B(Sα(t)) Uα(t) , Sα(t) α 0 0 25 t 2 0 −2 0 50 Fig. 1: (Colour on-line) Correspondence between the processes Uα (t) and its inverse Sα (t). They are obtained by reflection wrt the diagonal of the square. The trajectories of the first process are superlinear, whereas the behavior of the second one is sublinear. For every jump of Uα (t) we observe the corresponding flat period of Sα (t). Here α = 0.7. of anomalous diffusions and for each case we will identify an appropriate subordinator. Sub- and superdiffusion. – In the large family of anomalous diffusion processes, two distinct classes are of special importance. Namely, subdiffusion and superdiffusion. The first class is characterized by the sublinear in time mean-squared displacement. Its presence was reported in condensed phases [8], ecology [36], biology [33], and many more. The superdiffusive regime is characterized by the superlinear in time or even infinite (Lévy flights) mean-squared displacement. Superdiffusion is observed in the transport of micelle systems, bacterial motion, quantum optics (see [8] and references therein) and even in the transport of light in certain optical materials [37]. Clearly, the classical Brownian motion B(t) is not suitable for modelling of sub- and super-diffusion, since its fundamental feature is the linearity of the meansquared displacement. Nevertheless, by introducing the appropriate random time (α-stable subordinator) to the system, one is able to transform the standard diffusion B(t) into anomalous one. Let us denote by Uα (t) the strictly increasing α-stable Lévy process (subordinator) with the well-known formula for its Laplace transform α e−kUα (t) = e−tk , 0 < α < 1 [38,39]. By Sα (t) = inf{τ : Uα (τ ) > t} Fig. 2: (Colour on-line) In the top panel a trajectory of the process B(Uα (t)) is shown. The jumps of the process, which are inflicted by the subordinator Uα (t), are typical for superdiffusion. In the bottom panel a sample path of the process B(Sα (t)) is visualized. We observe the characteristic constant periods of the trajectory, which correspond to the constant periods of Sα (t). The process is subdiffusive. Here α = 0.7. obtain the new process X(t) = B(Uα (t)). Such an operation is called subordination and it was first introduced by Bochner [40]. The process B, called the parent process, is directed by the new operational time clock Uα called subordinator. It is easy to verify that the process X(t) is superdiffusive. Namely, its Fourier µ transform is of the form eikX(t) = e−tk , where µ = 2α. The trajectories of X(t) are discontinuous, see fig. 2. We can observe long jumps, which are characteristic for Lévy flights. Having in mind that the trajectories of the classical Brownian particle are continuous, we infer that the superdiffusive character of X(t) is inflicted by the subordinator Uα (t). Moreover, for the second moment of X(t) we have X 2 (t) = ∞, which is typical for Lévy flights. Fractional Fokker-Planck equations. – The probability density function (PDF) of X(t) satisfies the superdiffusive fractional Fokker-Planck equation (FFPE) [8] ∂p(x, t) ∂ µ p(x, t) = , ∂t ∂xµ ∂d where the operator ∂x µ is the Riesz fractional derivative. Thus, by the time change t → Uα (t), Brownian motion is transformed into superdiffusion. By the similar subordination method, we are able to transform B(t) into subdiffusion. Let us consider the following time-changed process Y (t) = B(Sα (t)). Here, Sα (t) is the previously introduced inverse α-stable subordinator. Now, the process Y (t) is subdiffusive. Its second moment is given by Y 2 (t) ∼ tα , 0 < α < 1, thus it is µ we denote the left inverse of Uα (t). We call Sα (t) the inverse α-stable subordinator. The correspondence between Uα and Sα can be observed in fig. 1. Namely, Sα (t) is obtained from Uα (t) by reflection wrt to a diagonal of the square. Clearly, the trajectories of Uα (t) are superlinear, whereas the behavior of Sα (t) is sublinear. Now, randomizing the time of the Brownian motion B(t) by using the independent random process Uα (t), we (4) 60010-p3 A. Weron and M. Magdziarz sublinear. The PDF of Y (t) obeys the subdiffusive frac- A typical framework for the treatment of anomalous tional diffusion equation [8,41] diffusion problems under the influence of an external force F (x) is in terms of the FFPE [8] 2 ∂p(x, t) 1−α ∂ p(x, t) , (5) = 0 Dt ∂t ∂x2 ∂F (x) ∂µ ∂p(x, t) = − + µ 0 Dt1−α p(x, t). 1−α ∂t ∂x ∂x where the operator D is the Riemann-Liouville frac0 t tional derivative. The trajectories of Y (t) are continuous with the characteristic flat periods, fig. 2. These constant periods are typical for subdiffusion and represent the time intervals in which the particle gets immobilized in the trap. Comparing figs. 1 and 2 we observe the clear correspondence between the flat periods of Sα (t) and Y (t). Thus, we conclude that the process Sα (t) is responsible for giving the effect of subdiffusion. Note that for α → 1 we have that ∂ The operator ∂x µ introduces the Lévy-flight–type behavior, whereas 0 Dt1−α causes the memory effects typical for subdiffusion. The analysis of the corresponding Langevin equation [35,48] shows that also in the presence of external force F (x), the underlying process can be represented as time-changed Brownian motion B(T (t)) for some appropriate subordinator T (t). As an example, let us consider the subdiffusive Ornstein-Uhlenbeck process defined by the above FFPE with F (x) = −x and µ = 2. Uα (t) = Sα (t) = t, Then, Y (t) can be represented as B(T (t)), where T (t) = 1 −2Sα (t) ). Concluding, there always exists an appro2 (1 − e which shows that the standard diffusion is placed exactly priate T (t) such that the time-changed Brownian motion on the border between sub and superdiffusion and when B(T (t)) describes sub or superdiffusion in the presence of the operational time coincides with the real time. external force. In general, the processes B and T do not It is worth mentioning that the subordination is have to be independent. Let us underline that the same reversible in the following sense: we have that arguments as above can be applied also for the case when the force is time-dependent F = F (t) [17]. B(Sα (Uα (t))) = B(t). µ Jump-diffusions. – Another significant class of anomalous diffusions constitute non-Gaussian Lévy processes, also known as jump-diffusion models due to their discontinuous trajectories. It is one of the most important and fundamental classes of random processes characterized by stationarity and independence of increments. Special examples include the Poisson, Compound Poisson, and stable Lévy motions. Since their introduction in the 1930s, Lévy processes were studied extensively by many mathematicians [49]. However, in recent years they attracted considerable attention of physical community, too [50]. Continuity of paths has always played a crucial role in the properties of classical diffusion models. Nevertheless, recent developments confirm that many transport phenomena (i.e. bacterial motion [6], transport of light in certain optical materials [37], stock prices [15]) display a discontinuous behavior. In such cases jumpdiffusion models rather than Brownian motion provide the proper background to describe and understand discontinuous transport. Every Lévy process L(t) can be fully characterized by its Fourier transform eikL(t) = e−tψ(k) , where the function ψ(k) is the so-called Lévy exponent. However, the most important fact here is that for each Lévy process L there exists a subordinator T (t) such that L(t) can be represented as B(T (t)) [15]. For example, to obtain the Linnik geometric stable process [51] one has to choose T (t) = Uα (Γt ), where Γt is the Gamma subordinator [49]. In general case, the assumption about the independence of subordinator and Brownian motion has to be relaxed. Concluding, the class of Lévy processes, which belongs to External force fields. – Many physical transport the family of anomalous diffusions, can also be described problems take place under the influence of external fields. as time-changed Brownian motion [7]. Thus, the double subordination recovers the classical Brownian diffusion. The first reasonable usage of subordination in physics dates back to [42], see also [43,44]. The time since, physicists developed a considerable intuition on subordination [45–47]. It should be noted that subordination in the sense of integral transformation of PDFs, when both processes (parent process and subordinator) are independent, is not enough for some purposes (see [45] for the calculation of first-passage times). This is related to the fact that in some cases PDF’s do not give the complete description of the underlying process. However, subordination represented as the superposition of two stochastic processes gives such full characterization of the process. The discussion on the duality of subdiffusion and Lévy flights in the framework of Continuous-Time Random walks (CTRW) and propagators for the case when subordinator is independent of Brownian motion, can be found in [46,47]. The authors of the above papers have demonstrated that, under assumption that the initial ticks of the physical clock follow extremely inhomogeneously and show intervals of high condensation, operational time leads to Lévy flights. This corresponds to the subordination (4). If the ticks triggering the motion of the random walker are taken from the set of ticks of a physical clock according to a power law waiting-time distribution, such random walk leads to the subdiffusive dynamics and FFPE (5). This corresponds to the subordination procedure of the form B(Sα (t)). 60010-p4 Anomalous diffusion and semimartingales Moreover, every standard CTRW process possesses the representation of the form B(T (t)) as well. It is not surprising, since the family of CTRWs is closely related to the class of Lévy processes, i.e. every Lévy process can be obtained as a limit of the appropriate CTRW [49]. Conclusions. – In this letter we have categorized the anomalous diffusion models (including: sub- and superdiffusion, CTRWs, and jump-diffusions) represented as time-changed Brownian motion. We have indicated the close and promising link between statistical physics (anomalous transport) and the theory of semimartingales. One should note at this point that not every anomalous diffusion process can be represented as time-changed Brownian motion. Such counterexamples are FBM and random walk on fractals. Both models do not belong to the family of semimartingales. The fact that a given physical process is a semimartingales, gives an important Ev a M nes od c el ent s Brownian Diffusions l na tio ns ac io Fr ot M Relaxation phenomena. – In recent years, the question of understanding the phenomenology of relaxation processes in various materials has attracted considerable attention [52–55]. It is surprising that in spite of the variety of materials and experimental techniques, the behavior of relaxing systems is very similar and can be described in terms of simple relaxation functions. Therefore, it is expected that there exists a common nature of microscopic relaxation mechanisms with the corresponding mathematical structure. It turns out that an unified mathematical structure can be provided in the framework of time-changed Brownian motion. Let us denote by R(t) the distance reached by the particle after time t. Then, the corresponding time-domain relaxation function Φ(t), describing the system’s survival probability in the initial state, is defined as the Fourier transform of R(t), i.e. Φ(t) = eikR(t) . Now, by the appropriate choice of R(t), we obtain different relaxation functions. For R(t) = B(Sα (t)), where Sα (t) is the previously introduced inverse α-stable subordinator, we get the Mittag-Leffler relaxation function. Next, for R(t) = B(T (t)) with T (t) = tUα (1) and Uα being the α-stable subordinator, we win the stretched exponential relaxation function. Moreover, subordinating the Brownian motion by the processes obtained as the limit of certain CTRWs leads to the Havriliak-Negami relaxation in [54], the generalized Mittag-Leffler relaxation in [53], and the ColeDavidson relaxation in [55] by employing the tempered stable distributions. As one can observe, randomization of the time of Brownian motion using the appropriate subordinator, provides a unified mathematical description of all the most relevant relaxation patterns. Different choice of subordinator results in different behavior of the anomalously relaxing systems. It suggests that complex systems can be identified and characterized by their own internal operational time. The determination of this operational time seems to be the key factor in understanding and describing of relaxation phenomena in complex systems. Semimartingales Fig. 3: (Colour on-line) A schematic structure (ring) of anomalous diffusion models: semimartingales (excluding Brownian diffusions), fractional motions, and evanescent models. According to the Embedding Principle only semimartingales can be embedded in the Brownian diffusion. additional information on the behavior of its trajectories. In particular, it is known that the trajectories of semimartingales are of finite quadratic variation. The different behavior of quadratic variations can be used to construct an efficient statistical test which differentiates between different types of subdiffusive dynamics in experimental data [31]. Detection of the origins of anomaly is an important and timely problem of statistical physics. The presented considerations indicate that complex systems displaying anomalous type of behavior can be identified by their subordinators representing internal operational time. In another words only such anomalous diffusions (semimartingales) can be embedded in Brownian diffusion. The determination of the proper subordinator is important here since it allows via Langevin equations to apply immediately Monte Carlo methods for solution of the corresponding FFPE [35,48], and for the numerical analysis of the trajectories. Therefore, the analysis of the subordinators of the system is yet another promising method leading to better understanding of anomalous behavior of complex systems. The Embedding Principle suggests also the interesting question on a general structure of anomalous diffusion models. Namely, according to the above analysis we have the following picture: a large class of semimartingales (excluding Brownian diffusions), fractional motions (including fractional α-stable motion and FBM), and a class of so-called evanescent models (including for example Langevin equations with fractional noise [56] etc.) see fig. 3. It should be noted that fractional differential equations are not directly related to semimartingales. For example, FBM is not a semimartingale and its PDF solves some fractional differential equation [57]. Coupled CTRW might lead in the limit to semimartingales [54]. However, this is not always the case, since FBM can be obtained as a limit of certain coupled CTRW [58]. 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