Time-reversal symmetries and equilibrium-like Langevin equations Lokrshi Prawar Dadhichi and Klaus Kroy Institute for Theoretical Physics Leipzig University 04103 Leipzig Germany

2025-05-06 0 0 478.24KB 15 页 10玖币
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Time-reversal symmetries and equilibrium-like Langevin equations
Lokrshi Prawar Dadhichi and Klaus Kroy
Institute for Theoretical Physics, Leipzig University, 04103 Leipzig, Germany
Graham has shown in Z. Physik B 26, 397-405 (1977) that a fluctuation-dissipation relation can
be imposed on a class of non-equilibrium Markovian Langevin equations that admit a stationary so-
lution of the corresponding Fokker-Planck equation. The resulting equilibrium form of the Langevin
equation is associated with a nonequilibrium Hamiltonian. Here we provide some explicit insight
into how this Hamiltonian may loose its time reversal invariance and how the “reactive” and “dis-
sipative” fluxes loose their distinct time reversal symmetries. The antisymmetric coupling matrix
between forces and fluxes no longer originates from Poisson brackets and the “reactive” fluxes con-
tribute to the (“housekeeping”) entropy production, in the steady state. The time-reversal even
and odd parts of the nonequilibrium Hamiltonian contribute in qualitatively different but physically
instructive ways to the entropy. We find instances where fluctuations due to noise are solely respon-
sible for the dissipation. Finally, this structure gives rise to a new, physically pertinent instance of
frenesy.
I. INTRODUCTION
A Langevin equation is a stochastic differential equa-
tion describing generic mesoscopic dynamics driven by
both systematic and stochastically fluctuating forces [1].
The concept is suitable for slow degrees of freedom cou-
pled to a large number of fast degrees of freedom that
can be subsumed into a “noisy” stochastic force. There
are multiple ways to derive Langevin equations from mi-
croscopic descriptions [1,2]. In equilibrium, the deter-
ministic part of the dynamics is governed by an effective
(i.e., typically coarse grained) Hamiltonian. It there-
fore relies on a crucial feature of equilibrium dynam-
ics, namely that the coarse-graining, by which one ex-
ploits the scale separation between the slow systematic
and fast stochastic degrees of freedom, leads one to a
free energy governing the slow variables that itself obeys
Hamiltonian symmetries. In this case, the stochastic
noise strength can moreover be fully specified mesoscop-
ically, by a fluctuation-dissipation relation (FDR) [35]
that obliges the fast degrees of freedom to act as an effec-
tive thermostat for the slow variables, so that the solu-
tions obtained for the latter from the Langevin equation
coincide with those from the classical Gibbs ensembles,
at late times. In this framework, dissipative and reactive
(reversible/conservative) contributions can be clearly dis-
tinguished.
Traditionally, the FDR is thus intimately associated
with thermal equilibrium [35] and its failure with a loss
of equilibrium. Indeed, a set of Langevin equations de-
scribing a generic nonequilibrium system is not obliged to
obey Hamiltonian dynamics nor any FDR. However, the
FDR has time and again been generalized to nonequilib-
rium conditions —pars pro toto we here refer to Refs. [6
15], and references therein. Interestingly Graham [16]
and later, inspired by his work, Eyink et al. [17] gave a
formal procedure to extend the FDR to generic nonequi-
lpdadhichi@gmail.com;klaus.kroy@uni-leipzig.de
librium mesoscopic Markov systems, whenever the exis-
tence of a stationary solution of the associated Fokker–
Planck equation (FPE) can be taken for granted. In
principle, it provides a formal effective Hamiltonian-like
structure reminiscent of a potential of mean force [18],
given by the logarithm of said stationary solution of the
FPE, to which we want to refer as the nonequilibrium
Hamiltonian (NH). As we recall and explicitly lay out
in the following, the nonequilibrium Langevin equations
rephrased in terms of this NH have the same structure
as in equilibrium. The NH is a Lyponov function for
the Langevin dynamics around the steady state, so that
the latter is unique and stable [16]. The resemblance
of the equations with the equilibrium structure, includ-
ing a formal FDR, naturally raises the question, where
the condition of nonequilibrium got hidden? As pointed
out in Refs. [16,17], it is hidden in the symmetry under
time reversal of the dynamical equation. Here, we dwell
deeper into this question and, through an exactly solvable
model (studied widely in active matter), demonstrate
how “dissipative” and “reactive” parts of the nonequilib-
rium Langevin equations violate the familiar equilibrium
time-reversal signatures. Additionally we show that the
time-reversal even and odd part of the NH contribute
to the entropy production in qualitatively different ways.
Apart from being a Lyponov function for a given steady
state, the (negative) NH is also related to the entropy
and the excess heat produced in a quasistatic operation
turning it into another steady state [19]. This provides
multiple reasons to study the effect of perturbing the
NH. Unlike the usual practice for nonequilibrium sys-
tems, where perturbing forces are directly added to the
equations of motion (which can be understood as a force
balance), here the perturbing force appears in the NH
with a special coupling [16]. In this context, we establish
the link to frenesy [20,21], which is a measure of the
“undirected” currents in a system.
More precisely, we show that, in such equilibrium-like
Langevin equations, the nonequilibrium condition mani-
fests itself in the following ways:
arXiv:2210.14255v2 [cond-mat.stat-mech] 21 Mar 2023
2
The NH need not be time reversal invariant.
The antisymmetric couplings do not arise from
Poisson brackets.
The “reactive” currents also produce entropy.
Similarly, fluctuations from the steady state,
due to the noise, can produce entropy (“ac-
tive/dissipative” fluctuations).
We also make the following important observations:
The parts of the NH with different time-reversal
signatures contribute in qualitatively different ways
to the entropy production.
The NH opens a new meaningful way to perturb the
system and hence provides a second interesting in-
stance of excess frenesy, beyond the usual one. We
also point out that this perturbation can be used to
derive a variant of, the Harada-Sasa relation [22].
The paper is organised as follows: in Sec. II we recall
the structure of equilibrium Langevin equations, Sec. III
summarizes Graham’s work [16] and establishes the
structural similarity between Langevin equations with
nonequilibrium steady states and equilibrium Langevin
equations. In Sec. IV, we analytically solve the FPE
corresponding to a linear nonequilibrium Langevin equa-
tion to explicitly reveal this equilibrium-like structure.
We discuss its interesting features, and, in Sec. V, apply
this formalism to a much studied model in the physics
of soft active matter, namely so-called active Ornstein–
Uhlenbeck particles (AOUPs) [23]. In Sec. VI, the role of
different parts of NH in the entropy production is stud-
ied. Finally, Sec. VII provides the link to frenesy in this
context and a comparison with previous studies [21].
II. EQUILIBRIUM STRUCTURE
We construct equations of motion for dynamical vari-
ables Cwith position-like and momentum-like compo-
nents Qand P, respectively, even and odd under time-
reversal (hereafter denoted by T). We allow Cto be
finite or infinite-dimensional, depending on whether we
are dealing with a system parameterized in terms of par-
ticle degrees of freedom or with a spatially extended sys-
tem described by a stochastic field theory. In particle
systems in thermal equilibrium, Qand Pnormally refer
to canonically conjugate variables, but in more strongly
coarse-grained formulations [24], and in particular in gen-
eralized non-equilibrium Langevin systems, they do not
have to, nor do they need to have the same number of
components. The stochastic equations of motion describ-
ing the thermal equilibrium dynamics of Care [1,2426]
tC=(Γ+W)·CH+T ∂C·W+ξ(1)
where H(C) is the effective Hamiltonian, Γis a symmetric
matrix of dissipative couplings between the variables that
governs the FDR
hξ(t)ξ(t0)i= 2TΓδ(tt0),(2)
and Wis an antisymmetric matrix of reactive couplings.
For brevity, we are using the notation for discrete de-
grees of freedom, which can however straightforwardly
be upgraded for the case that Cis supposed to be a field
variable; e.g., the term W·CHwould read
Zdx0Wµν (x,x0)δH
δCν(x0)(3)
(summation over νimplied).
Terms involving Wmust have, component by compo-
nent, the same signature under Tas tC, and those in-
volving Γmust have the opposite T-signature. Thus the
QQ and PP components of the matrix Γmust them-
selves be even under T, while its QP and PQ compo-
nents must be odd. In equilibrium, Wis identified with
the Poisson bracket between the dynamical variables as
discussed later in this section [24,25].
Standard derivations of generalized Langevin equa-
tions [2,24,25,27] require the additional term TC·W
in Eq. (1) for the steady state to be eH/T . While it
vanishes in familiar equilibrium Langevin equations [28],
there are natural instances in active matter where it is
nonzero [29]. Moreover, when Γdepends on C, the noise
term in (1) is multiplicative. It then produces a spurious
drift. For the steady-state distribution to remain eH/T ,
we must then include, as a counter term, the additional
drift T(C·Γαg· ∇Cg), in Eq. (1), where g·g=
[26], and the continuous parameter α[0,1] parameter-
izes different physical interpretations of the noise. Simi-
larly, WPP should be odd under Tand therefore suitably
P-dependent.
For an equilibrium system, the reactive (reversible)
term emerges from the Poisson bracket of the variable
with the Hamiltonian [24,25].
tCµ={H, Cµ} ≡ −Wµν CνH(4)
The antisymmetric coupling matrix Wµν =−Wνµ =
{Cµ,Cν}has the structure of a Poisson bracket of the
dynamical (field) variables. And, again, an extra term
µWµν is required in the reactive part to attain a Boltz-
mann equilibrium distribution. Hydrodynamic Poisson
brackets are usually calculated directly from a micro-
scopic model [30] or indirectly inferred from symmetries
[31].
In general, the above effective Hamiltonian structure,
and hence the clear identification of reactive and dissipa-
tive currents, breaks down for nonequilibrium systems,
which naturally raises the question how much of it can
be rescued for the special subclass of Markov systems
that admit non-equilibrium steady states (NESS).
3
III. GRAHAM’S EQUILIBRIUM-LIKE
STRUCTURE
Graham [16] and later, inspired by his work, Eyink et
al. [17] gave a formal procedure how to write nonequilib-
rium Markovian equations in an equilibrium-like form, in
which Eqs. (1), (2) still pertain. In particular, Eyink et
al. pointed out that the “dissipative” (symmetric) cou-
pling governing the strength of the noise correlation actu-
ally establishes a FDR of the first kind, as discussed fur-
ther below. Here we summarise the results that are use-
ful for our present purpose. Namely, a general Langevin
equation (for discrete degrees of freedom)
˙
Cµ=Jµ(C) + gi
µ(C)ξi(5)
where
hξi(t)ξj(t0)i= 2δij δ(tt0)Qµν (C) = gi
µ(C)gi
ν(C) (6)
can be written as
˙
Cµ=(Qµν +La
µν )Cνφ+CνLa
µν +gi
µ(C)ξi(7)
with antisymmetric couplings La
µν Fµν eφ, where Fµν
itself is antisymmetric and defined by
rµP0(C)CνFµν .(8)
We now clarify this notation. First, φln P0(C) is the
logarithm of the steady-state solution P0(C) of the asso-
ciated Fokker–Planck equation corresponding to Eq. (5),
namely
tP(C, t) = Cµ[Jµ(C)P(C, t)Qµν (C)CνP(C, t)]
(9)
Following the equilibrium paradigm [24], the determinis-
tic flux Jµ(C) is broken into “dissipative” and “reactive”
contributions, dµ(C) and rµ(C)Jµ(C)dµ(C), respec-
tively, where the former has the explicit form
dµ(C) = Qµν (C)Cνφ(10)
Using Eq. (8) and the definition La
µν Fµν eφ, the re-
active current can be cast into the explicit form
rµ(C) = La
µν Cνφ+CνLa
µν (11)
The point we want to make here is that the structure
of the dissipative and reactive terms in the equilibrium
and equilibrium-like description is exactly the same, i.e.
Eqs. (7) and (6) are structurally identical to Eqs. (1)
and (2). The identification of the symmetric coupling
with the noise strength is also present in both cases, es-
tablishing an FDR of the first kind, as noted in Ref. [17].
One very important difference is that, unlike in equilib-
rium, the antisymmetric coupling is not obliged to orig-
inate from a Poisson bracket, in the generic case. It can
however easily be seen that the generic antisymmetric
coupling, Laboils down to a Poisson bracket W, in the
equilibrium limit, where φ=H. Then, the antisym-
metric coupling is Weφeφ, and equating this with La
gives
Fµν =Wµν eH(12)
Taking its derivative and using (8), we then find
rν=Wµν CµHCµWµν ,(13)
consistent with the equilibrium formalism [24,25].
In summary, Eqs. (1) and (7) have an identical form,
and the symmetry of the coupling coefficient with respect
to an interchange of its indices is also the same. However,
when the dynamics is governed by Eq.(1), the system is
in equilibrium, whereas Eq. (7) can describe both equilib-
rium as well as nonequilibrium dynamics. This prompts
the question where is the nonequilibrium condition hid-
den in Eq. (7)? It is clear from the above discussion
that an explicit description of a nonequilibrium dynam-
ics by Eq. (7) requires the knowledge of its steady-state
distribution. In general, the latter will be very difficult
to find. Therefore, we study in the following an exactly
solvable linear system to provide explicit answers to the
theoretical questions raised and to illustrate the general
statements promised in the Introduction I.
IV. A SOLVABLE MODEL
As described above, for a given (effective) Hamiltonian
and noise correlation matrix in an equilibrium system,
the reactive and dissipative terms come out naturally
with the correct time reversal signatures. But things get
more complicated once the system is out of equilibrium.
Here we discuss the linear case, which can be solved ex-
actly, to see how the classification of the terms as reactive
and dissipative looses meaning. Our starting point is the
following set of coupled linear equations.
˙α=1
ΓαH+ ˜υβH+ξα(t) (14)
˙
β=˜υαH1
γβH+ξβ(t) (15)
associated with the quadratic Hamiltonian
H=1
2Kα2+1
2kβ2(16)
where Kand kare positive stiffness constants; ˜υis a pos-
itive constant. The Markovian noise correlation matrix
shall be given by
D= 2 1
Γ0
01
γδ(tt0) (17)
摘要:

Time-reversalsymmetriesandequilibrium-likeLangevinequationsLokrshiPrawarDadhichiandKlausKroyInstituteforTheoreticalPhysics,LeipzigUniversity,04103Leipzig,GermanyGrahamhasshowninZ.PhysikB26,397-405(1977)thatauctuation-dissipationrelationcanbeimposedonaclassofnon-equilibriumMarkovianLangevinequations...

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