Exact nonequilibrium quantum observable statistics: A large-deviation approach
Stefano Gherardini

TL;DR
This paper derives the exact large-deviation probability distribution for quantum observable outcomes in nonequilibrium systems, providing insights beyond average values and confirmed by numerical simulations.
Contribution
It introduces an analytical large-deviation framework for quantum observable statistics, capturing fluctuations due to measurements and environment interactions.
Findings
Exact large-deviation form of quantum observable statistics derived.
Most probable measurement outcome distribution obtained.
Numerical simulations confirm theoretical predictions.
Abstract
The exact statistics of an arbitrary quantum observable is analytically obtained. Due to the probabilistic nature of a sequence of intermediate measurements and stochastic fluctuations induced by the interaction with the environment, the measurement outcomes at the end of the system's evolution are random variables. Here, we provide the exact large-deviation form of their probability distribution, which is given by an exponentially decaying profile in the number of measurements. The most probable distribution of the measurement outcomes in a single realization of the system transformation is then derived, thus achieving predictions beyond the expectation value. The theoretical results are confirmed by numerical simulations of an experimentally reproducible two-level system with stochastic Hamiltonian.
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Exact nonequilibrium quantum observable statistics: A large-deviation approach
Stefano Gherardini
Department of Physics and Astronomy & LENS, University of Florence, via G. Sansone 1, I-50019 Sesto Fiorentino, Italy.
INFN Sezione di Firenze, via G. Sansone 1, I-50019 Sesto Fiorentino, Italy.
Abstract
The exact statistics of an arbitrary quantum observable is analytically obtained. Due to the probabilistic nature of a sequence of intermediate measurements and stochastic fluctuations induced by the interaction with the environment, the measurement outcomes at the end of the system’s evolution are random variables. Here, we provide the exact large-deviation form of their probability distribution, which is given by an exponentially decaying profile in the number of measurements. The most probable distribution of the measurement outcomes in a single realization of the system transformation is then derived, thus achieving predictions beyond the expectation value. The theoretical results are confirmed by numerical simulations of an experimentally reproducible two-level system with stochastic Hamiltonian.
PACS numbers
05.30.-d, 03.65.Yz, 03.65.Ta
I Introduction
Observables of a quantum system out-of-equilibrium return random outcomes fluctuating with a specific probability distribution BookJacobs . By following the operational approach DaviesBook , a quantum stochastic process BookPetruccione ; ReviewHuelga can be envisaged as a nonequilibrium transformation modeled as the composition of stochastic evolutions characterized by semi-classical fluctuations of the system parameters GherardiniErgodicity ; MuellerAnnalen ; RossiPRA2017 and intermediate quantum measurements CampisiPRL2010 ; ThielPRL2018 . In the former case, especially in quantum computing, stochastic fluctuations can arise from imperfections in the physical realization of the quantum system or through the interaction with the environment MishraNATCOMM2018 . On the other hand, repeated quantum measurements could correspond to a process exchanging photons with the environment HekkingPRL2013 or could be adopted to ensure the protection of coherent evolutions of a quantum system by decoherence (quantum Zeno dynamics) FacchiPRL2002 . Experimentally, together with strong coupling methods, such dynamics have been realized in several physical setups such as solid-state spins, superconducting qubits or ultracold atomic gases UhrigPRL2007 ; LangeScience2010 ; PokharelPRL2018 ; SchaferNAT2014 ; SignolesNAT2014 ; GherardiniErgodicity . They are also relevant in quantum metrology PezzeReview2018 to probe the phase evolution of an atomic ensemble by means of interleaved interrogations and feedback corrections KohlhaasPRX2015 ; SchioppoNAT2017 . In this scenario, by observing only once the dynamics of the system (single realization), the ensemble average of the measurement outcomes does not provide complete information about the statistics of the measured results. This becomes more evident when also one rare random event, i.e. a stochastic fluctuation with very small probability, occurs within the system dynamics Chantasri2013 ; WeberNature2014 ; Chantasri2015 . Such a concept is at the heart of the Large Deviation (LD) theory Ellis1 ; Touchette1 , dealing with the exponential decay of probabilities associated to large fluctuations in stochastic classical Dembo1 and quantum systems Gallavotti2002 ; Netocny2004 ; GarrahanPRL2010 ; LesanovskyPRL2013 ; PigeonPRA2015 ; Collura2019 .
In this paper, we derive a closed-form expression for the outcomes’statistics obtained by measuring a quantum system repeatedly monitored by an external observer and whose dynamical evolution depends on random parameters. In particular, we prove that for a sufficiently large number of intermediate quantum measurements, the probability distribution of the last measurement results obeys the so-called LD principle Touchette1 ; GherardiniNJP ; thesis_Stefano . This means that the behaviour of the measurement outcomes’ distribution is a decaying exponential in , whose exponent is equal to the relative Shannon entropy between the configurations of the stochastic system dynamics. In other words, only a rigorous description of the occurrence combinatorics of the parameters defining the stochastic evolution of the system allows for the full characterization of the outcomes’ statistics, also beyond the Gaussian approximation given by the sole description of the measurement apparatus.
II Model
Let us consider an arbitrary quantum system within the Hilbert space . We assume that is initialized in the quantum state with density matrix and that the Hamiltonian of the system is time-independent. At the level of the single trajectory, we assume that the random interaction between and an environment gives rise to a sequence of stochastic dynamical evolutions, separated by consecutive quantum projective measurements footnote1 , following the postulates of quantum mechanics Sakurai1994 . Hereafter, the index denotes the dimension of , while the index denotes the instants composing the temporal sequence of measurements. More specifically, we assume that the first measurements are performed on the quantum observable , where are the outcomes of and is the set of projectors corresponding to the measured eigenvalues at time . The th measurement, instead, is performed on the quantum observable , whose outcomes are recorded by the observer. According to the postulate of quantum measurement, the state of after the projective measurement at is identically equal to one of the projectors defining the measurement observable. Then, between each projection event the system undergoes a dynamics, that is governed by the Hamiltonian and described by the completely-positive and trace-preserving quantum map Caruso_RevModPhys_2014 . If we assume quite large number of intermediate quantum measurements, the dynamics between measurements is described by a unitary operator, so that is simply given by the super-operator , where , is set to unity and . We also assume that, in accordance with the recently introduced stochastic quantum Zeno phenomena GherardiniNJP ; GherardiniErgodicity ; MuellerAnnalen , there exists for each propagator at least one dynamical parameter , that is a fluctuating variable. For example, one could consider as in Gherardini_heat_stat ; MukherjeePRE2018 that each is equal to the time interval , with random. Moreover, the ’s between the measurements are taken as constant and have a different random value only after the occurrence of a new measurement, according to the probability density function . Here, denotes the sequence of dynamical parameters in a single realization of the system transformation. The fluctuating dynamical parameters , then, are taken as independent and identically distributed (i.i.d.) random variables sampled from , since the environment is a-priori unknown.
The stochastic nature of the measurement outcomes ’s at time lies in the specific values assumed by and . Thus, being the dynamics of stochastic, the single realization of the system density matrix at the end of its evolution is a fluctuating variable, i.e., given the sequences and , it is mapped into
[TABLE]
where is the measurement super-operator acting on at , with . Consequently
[TABLE]
i.e. , denotes the conditional probability to obtain the outcome from the measurement of given the specific realization of the sequences and .
III Quantum observable statistics
In a single realization of the system transformation, and depend on and and are random quantities. Thus, the following question naturally emerges: Which is the best description for the statistics of the measurement results from the observation of at ? Three possible answers, characterized by an increasing degree of prediction accuracy, can be provided. First, one could describe the probabilistic expected result from the measured outcomes by using the expectation value , with
[TABLE]
and denoting the occurrence joint probability of the dynamical parameters . It is worth noting that is equal to the ensemble average of all possible measurement outcomes. Second, the probability distribution of ’s outcomes (green line in Fig. 1) can be introduced:
[TABLE]
where and is the Kronecker delta. Eq. (4) defines the statistics of , while (red dots in Fig. 1) is the probability to obtain on average the th outcome . Otherwise, the third option that we are here proposing is to adopt the probability distribution of the conditional probabilities , i.e. (in Fig. 1, the blue dashed lines for each outcome ), defined over all the possible realizations of the sequences and . Only in this way, by deriving , one will be able to get the most probable statistics (orange dotted line) for the quantum observable connecting the blue dots in Fig. 1.
We start by observing that the ’s can be written as the product of the probabilities – also called dynamical transition probabilities – that the quantum state moves from to via the propagator (see the Appendix for more details). Specifically, ’s are the eigenvectors that define the measurement projectors , with equal to or , depending on whether the observable or is measured. Thus, one has that
[TABLE]
where , (with ), for and .
IV Large deviation formalism
We now derive the main result of this paper, namely a closed-form expression of the distributions. Notice that if we just characterize the quantum observable at and at the same time the hypotheses of the central limit theorem are respected, then the statistics of its outcomes is well represented by a Gaussian probability distribution. In fact, with this assumption, outliers in the outcomes statistics are simply classified as the result of a non-modeled experimental noise on the measurement apparatus. Thus, by increasing the number of realizations, the occurrence probability of the outliers naturally decreases and the Gaussian distribution well fits the data. However, this evidence is no longer valid if we assume that the statistics of ’s is given by an arbitrary stochastic transformation governing the dynamics of the system. In such a case, the configuration space defined by the occurrence of random events during its evolution becomes exponentially larger, but allows for the description of the outliers’statistics with occurrence probability greater than zero and not satisfying the Gaussian approximations. Therefore, we expect to increase our prediction power on the outcomes’ distribution by statistically characterizing the trajectories of the system before the measurement of . This amounts to computing the statistics of the dynamical transition probabilities as defined in Eq. (5). Briefly, the procedure to derive the exact LD form of is to take the logarithm of the conditional probabilities , i.e. , compute its distribution and then apply the contraction principle from LD theory Touchette1 .
For the sake of clarity, let us here consider that the measurement bases of and , with , belong to a set of finite dimension, i.e. that each measurement eigenvector admits only a finite number of elements . Then, the distribution of is obtained as following. By following a common procedure in LD theory, the terms of are grouped as a function of the number of times each dynamical transition probability occurs, where the superscripts and stand, respectively, for “Before” and “After” the evolution via the propagator . In this way, is recast in the following sum of i.i.d. random variables:
[TABLE]
with denoting the relative frequencies for the occurrence of the ’s, usually different from the corresponding probability value . The deviation between them vanishes only by attaining a complete statistics for each admissible value of . This latter condition can be in principle realized, but likely a quite long system dynamical evolution could be required.
The probability distribution of a sum of i.i.d. random terms can be always written as an exponential, linearly decaying in with large. In particular, regarding , it is given by an exponential distribution decaying in the number of projective measurements (see Appendix for more details), i.e.
[TABLE]
In Eq. (8), the function , also called the rate function associated to the probability distribution , equals to
[TABLE]
where for each set of system parameters. The rate function is the Kullback-Leibler distance (or relative entropy) between the set of scaled relative frequencies and the set of probabilities , and, thus, has the properties to be positive and convex. Eq. (8) is valid in the limit of large and indicates a unique nonequilibrium weighted partition of the system configuration space (see the Appendix for the proof). For a small value of , indeed, the distribution cannot be uniquely determined. The latter can be considered as a universal property of any dynamical evolutions given by the composition of quantum maps and projections. The alternative LD expression of Eq. (8), providing the formal definition of , is
[TABLE]
where the number of measurements is assumed ideally infinite. If Eq. (10), also called the large-deviation approximation, holds, it means that the dominant behaviour of is convergent and identically equal to a decaying exponential in .
As last, through the contraction principle footnote4 , the distribution is obtained:
[TABLE]
Then, by applying the saddle point method BookWong1989 , one has that
[TABLE]
where
[TABLE]
The result is that a quantum system exhibiting stochastic evolutions (e.g. due to random interactions with the environment) and repeatedly monitored by an observer tends to reach in probability a unique configuration defined by specific probability distributions of its characteristic parameters.
IV.1 Most probable distribution
The expression of the most probable distribution of ’s outcomes is here discussed. In general, from the knowledge of the rate function associated to , we can then compute the most probable value , representing the best prediction for the random variable in a single realization of the system dynamics. Specifically, the most probable value of the log-conditional-probability , i.e., , is obtained by evaluating the value at which the rate function is minimized as a function of . As proved in the Appendix, the closed-form expression of is
[TABLE]
corresponding to the statement that for every . This means that for large the most probable trajectories of the system dynamics are those allowing for the equality between the scaled relative frequencies and the occurrence probabilities . Only this condition minimizes the relative Shannon entropy between the configurations induced by the stochastic dynamics of the system. Once more, it is worth observing the importance of imposing ; indeed, the value of the scaled relative frequencies can get closer to that of the probabilities only if the number of configurations generated by the stochasticity within the dynamics is as large as possible. Finally, to derive the most probable value of the conditional probabilities , we use again the contraction principle from LD theory, but this time on the functional relation between and , i.e. :
[TABLE]
V Discussion
Having proved that the nonequilibrium statistics of an arbitrary observable obeys the LD principle for a sufficiently large number of intermediate projection events, the answer to the original question is given by the distribution of ’s outcomes with occurrence conditional probabilities equal to . Such a distribution is denoted as the most probable distribution (see e.g. Fig. 2 inset (a)):
[TABLE]
which has to be normalized by the factor so as to ensure that . Accordingly, the predictions about the result of single-shot measurements from according to the most probable distribution are expected to be more accurate than the ones that we would obtain by directly computing the expectation value of the measurement outcomes. This is because large fluctuations within the evolution of the system are now properly weighted and thus correctly included in the outcome distributions. In this regard, also quantum noise sensing techniques DegenReview2017 could be used, so as to improve the a-priori information on .
In conclusion, being the average explicitly equal to
[TABLE]
one can observe a deviation between the most probable values and the probabilities to measure on average the outcome at the final time instant . Specifically, by applying Jensen’s inequality footnote2 to and , the inequality is obtained. The latter well justifies the introduction of the normalization factor in Eq. (16). In fact, the normalization of has to be ensured, and the values of the ’s are thus corrected by dividing for , so that , .
VI Experimental proposal
Let us consider a two-level system (2LS) with Hamiltonian , with (in natural units s.t. ) and Pauli matrices. This system, realized e.g. within a Bose-Einstein condensate of Rubidium atoms confined by a magnetic micro-trap as in GherardiniErgodicity , is intrinsically stochastic due to random fluctuations of the angle . They can be produced for example by a random coupling between the system and the laser source that coherently drives it. In particular, we assume sampling of from the Rayleigh probability distribution with scale parameter . Then, the 2LS, starting from the ground , is monitored by a sequence of repeated projective measurements. They are separated by the constant time interval (in natural units) and defined by the projectors and . After each dynamical evolution with whole duration , the quantum observable
[TABLE]
is measured, where the measurement outcomes and identify the percentage of system population respectively in the ground and excited states, and respectively. Notice that, being a 2LS, we analyze the fluctuations of only the conditional probability .
In Fig. 2-(a) we show the most probable values of , i.e. (solid red curve), which has been computed by plotting the analytical expression of Eq. (15) as a function of . The following procedure has been followed. First, we have numerically computed the probabilities (blue points in Fig. 2-(a)) to measure the measurement outcome after each realization of the system stochastic transformation (see inset (b)). Then, we have derived the quantity , by distinguishing between values of smaller (dotted blue curve – inset (c)) and greater (dashed red curve – inset (c)) than . As it can be observed, only the dotted blue curve is practically constant for and equal to . In particular, from the theoretical findings, we can state that for large (solid red curve – inset (a)) with
[TABLE]
for this specific example, where and encodes the occurrence probabilities of the intermediate quantum measurement projectors. As a further test, we have numerically obtained the probability distribution of (inset (d)) with , by repeating times the dynamics of the system, and computed the value of at which admits the peak; we measured and an average value . This value should equal to the most probable value and this has been effectively verified by the numerics, since from the solid red curve in Fig. 2-(a) we find for the value .
VII Conclusions
These results combine out-of-equilibrium quantum systems with statistical mechanics methods: They are expected to be a tool to defeat noise in a quantum system, since they provide predictions of the stochastic evolution of the system after the single realization.
The author gratefully acknowledges F. Caruso and M. Artoni for a detailed reading of the paper, A. Trombettoni and M. Fattori for several useful comments, and Shamik Gupta for insightful discussions on LD theory, in particular on the derivation of the measurement outcomes’probability distribution. S.G. was financially supported from the Fondazione CR Firenze through the project Q-BIOSCAN.
Appendix
I. Measurement conditional probabilities
Let us express the measurement projectors applied at time instants , , as a function of their eigenvectors , i.e. , with . Thus, by substituting the definition of the measurement super-operators and into the equation
[TABLE]
the conditional probability can be written as the product of the transition probabilities (random terms) that the quantum state moves from to via the unitary operator :
[TABLE]
is the initial density matrix of the open quantum system before the transformation induced by random interactions with the environment and the monitoring by an observer. Moreover, we also assume that is defined by the pure state , i.e., . For example this assumption is verified when the measurement outcomes at the final time are obtained by a two-time measurement scheme CampisiPRL2010 . In such a case, indeed, is the density matrix of after the first measurement of the scheme, and thus it is described only by a pure state. Therefore, under this further hypothesis, one has that , so that
[TABLE]
with , for and .
II. Derivation of via LD theory
The log-probability is the logarithm of the conditional probability defining the probability to obtain the -th measurement outcome at the time instant , conditioned to the specific realizations of the sequences and . More formally,
[TABLE]
For the sake of clarity, let us assume the following two hypotheses: (i) is assumed to be a dimensional Bernoulli distribution, with the result that at each time instant the parameter takes on possible values with corresponding probabilities so that . The index denotes the values that can be assumed by . (ii) The measurement bases of and , given by the set of eigenvectors , belong to a set of finite dimension and this means that each ket admits only a finite number of elements with probability . Notice that the index for the dimensionality of the measurement basis configurations is , as well as that for the dimension of . By following a common procedure in LD theory, we group the terms of as a function of the number of times (relative frequencies) each dynamical transition probability occurs during the transformation of the system. We denote with the relative frequencies for the occurrence of the ’s. The corresponding occurrence probabilities, instead, are denoted as . Over many realizations of the system transformation, one can reasonably assume that is sampled by a uniform distribution, such that and . The latter procedure directly leads to the analytical expression of , i.e.,
[TABLE]
Eq. (25) shows us that can be written as the sum of the i.i.d. dynamical transition probabilities , weighted by the relative frequencies corresponding to the occurrence statistics of the ’s. Notice that the relative frequencies are usually different from the corresponding probability values . Then, by taking Eq. (25), the distribution probability of is given by
[TABLE]
where denotes the Kronecker delta. Let us observe that in Eq. (II. Derivation of via LD theory), to simplify the notation, we have used the symbols and to denote respectively and . Then, by imposing in Eq. (II. Derivation of via LD theory) the condition given by the Kronecker delta, one has that
[TABLE]
where the relative frequencies ’s have to satisfy the following constraints:
[TABLE]
By combining together the constraints (28), we obtain a unique constraint equation for , i.e.,
[TABLE]
where
[TABLE]
It is worth observing that in deriving the constraint (29) we have chosen as the reference triplet of the configuration space that defines the stochastic trajectory of the system dynamics in a single realization. This choice is arbitrary and represents a degree of freedom of the procedure. However, that is not surprising because the number of constraints of formula (28) is smaller than the number of relative frequencies , so that the values of that satisfy Eq. (27) are generally not uniquely determined. This means that in order to obtain a unique analytical expression of , we need to answer the following questions: Which are the unique values of the relative frequencies obeying the constraint equation (29)? By generalizing the results in GherardiniNJP , we can prove that there exists a unique value for the ’s, under the hypothesis of a sufficiently large number of intermediate projective measurements. To see this, let us consider the product with generic indices :
[TABLE]
i.e.,
[TABLE]
Being ’s relative frequencies, it still holds that , for each triplet except , with the result that
[TABLE]
with denoting the corresponding scaling factor. Thus, this means that for large
[TABLE]
for each triplet . Eq. (34) is a quite important result, since it denotes the existence of a unique nonequilibrium weighted partition of the system configuration space, once we have fixed the reference triplet . Such a property is thus the key point for the derivation of . In particular, by summing together the terms over all the possible values that can be assumed by except for the triplet , we find that
[TABLE]
where is the dimension of the statistical ensemble defining the stochastic transformation of the system from to . Therefore, by comparing Eqs. (29) and (35), one can state that , so that for sufficiently large
[TABLE]
Once we have obtained a closed solution for the value of the relative frequencies obeying the constraints (28), we are able to validate the exponential approximation given by the large-deviation principle for the probability distribution of in the thermodynamic limit of . To practically derive the LD form of , just take Eq. (27) and apply the Stirling approximation on and , which is valid again in the limit of large :
[TABLE]
Then, by substituting the expression of ’s given by Eq. (36), after straightforward calculations one finds that
[TABLE]
where
[TABLE]
is the rate function associated to the probability distribution . In particular, in Eq. (39),
[TABLE]
for each triplet , while
[TABLE]
As a final remark, given the generic triplet , it is worth noting that and the relative frequency are simply related by the following equation:
[TABLE]
III. Most probable distribution
Here, the most probable value of the log-conditional probability is derived. The latter is obtained by evaluating the value at which the rate function of Eq. (39) is minimized as a function of in the thermodynamic limit of . is a positive and convex function – see Appendix II – and is given by a convex sum of the dynamical transition probabilities . Thus, sufficient condition for its minimization is that the identities
[TABLE]
(computed in correspondence to ) are all simultaneously verified for each triplet . If we perform the derivative of with respect to , then we find that the identities (43) for the triplets apart from can be equivalently written by means of an unique equation, i.e.,
[TABLE]
By summing both sides over , we get
[TABLE]
which, by using , gives
[TABLE]
It is worth observing that Eq. (46) represents the condition for the minimization of the rate function with respect to . This means that the most probable trajectories of the system dynamics are those allowing for the equality between the summations of the relative frequencies and the occurrence probabilities , respectively. Therefore, this also implies that in general the same value of can be obtained by more than one trajectory within the configuration space of the system, each of them corresponding to a different realization of the stochastic dynamics of the system.
By combining Eq. (46) with the expression of , using Eqs. (30), (40) and substituting with , one has that
[TABLE]
for each triplet . Then, if we extend Eq. (46) by assuming that , then
[TABLE]
Since Eqs. (III. Most probable distribution ) have to be verified for each triplet of the system configuration space, this means that Eqs. (III. Most probable distribution ) are identically equivalent to the relation
[TABLE]
finally providing us the analytical expression of the most probable distribution as given by Eq. (14).
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