1. Introduction
In this paper, we are interested in the study of the following three equations:
(1.1)
(1.2)
(1.3)
where
is expected to be small (it is related to the inverse of the penalty modulus),
is the order parameter, while
is the microconcentration and
the (relative) temperature. Furthermore, here and below, we set all physical parameters equal to one and we refer the interested reader to [1]-[12]. In particular, in the presence of the microconcentration, the total (Ginzburg-Landau type) free energy associated with the problem read (see [13]):
(1.4)
where the potential
is such that
,
is the domain occupied by the system (we assume here that it is a bounded and regular domain of
,
or 3, with boundary Γ), and the enthalpy
(1.5)
As far as the evolution equations for the order parameter are concerned, one postulates the relaxation dynamics (with relaxation parameter set equal to one)
(1.6)
where
denotes a variational derivative with respect to u, which yields (1.1) and (1.2). Then, we have the energy equation
(1.7)
where q is the heat flux. Assuming finally the usual Fourier law for heat conduction
(1.8)
we obtain (1.3).
The microconcentration model was used in [14] in an application to lithium-ion batteries, coupled with finite deformation elastoplasticity. The computational advantage of the microconcentration approach, compared to the standard classical conserved phase-field model, is that less regularity of shape functions is required for the concentration variables in a finite element setting [15].
Our aim in this paper is to prove the aforementioned convergence. We also prove the well-posedness to the conserved phase-field model based on microconcentrations and obtain error estimates on the difference of the solutions to this model and the classical conserved phase-field model, on finite time intervals. Finally, we prove the existence of global attractor and we give some numerical simulations.
2. Our Problem
We recall that we are interested in the following initial and boundary value problem:
(2.1)
(2.2)
(2.3)
(2.4)
(2.5)
in a bounded and regular domain
,
or 3, with boundary Γ;
denotes the unit outer normal to Γ and
denotes the normal derivative on Γ. In particular, we assume, throughout this paper, that
(2.6)
As far as the nonlinear term is concerned, we make the following assumptions:
(2.7)
(2.8)
(2.9)
(2.10)
where
.
Remark 2.1. In particular, the usual cubic nonlinear term
satisfied these assumptions and
.
3. Preliminaries and Notation
We introduce here our main assumptions, together with several mathematical tools which are needed in order to give a precise analytical statement of our results.
We denote by
the spatial average of a function
,
and, for
,
where
denotes the duality product. Furthermore, we set
where
denotes the conjugate of
.
We then set
and
Integrating (2.1) over the spatial domain
, we have, owing to (2.4),
(3.1)
Furthermore, integrating then (2.2) and (2.3) over
, we obtain resp.
(3.2)
so that, also,
(3.3)
and
(3.4)
which also yields, owing to (3.1),
(3.5)
We thus have the conservation of temperature, the conservation of mass, both for the order parameter
and the microconcentration
.
Let
be the operator defined by
where
denotes the usual
-scalar product, with associated norm
, and the operator
is an unbounded linear, selfadjoint and positive operator with compact inverse and is an isomorphism from onto its dual. Furthermore,
and
,
,
, is equivalent to
We will thus write
instead of
in what follows, meaning that we consider that this operator acts on functions with null spatial average; of course, it can also be defined on functions with nonvanishing spatial average. We refer the interested reader to, e.g., [16] for more details on this. Having this, we can rewrite, equivalently, (2.1) in the (weaker) form:
(3.6)
noting that
and
We only keep one boundary condition on
, namely
(3.7)
Remark 3.1. In particular, it follows from (2.1) to (2.3) that
(3.8)
(3.9)
which we can rewrite in the following (at least formally) equivalent form:
(3.10)
(3.11)
where
denoting the minus Laplace operator with Neumann boundary conditions and acting on functions with null average. Also recall that
(3.12)
Alternatively, we can rewrite (2.2) in the equivalent form:
(3.13)
allowing us to rewrite (3.10)-(3.11) in the equivalent form:
(3.14)
(3.15)
This shows that we can rewrite (2.1)-(2.4) as an equivalent problem for the sole unknown
.
We set
;
is a norm on
which is equivalent to the usual
-norm. More generally, we denote by
the norm on the Banach space X.
Throughout this paper, the same letters
,
and
denote (nonnegative or positive) constants which may vary from line to line, or even in a same line, and which are independent of
(but may depend on
).
4. Priori Estimates
In this section, we will establish a number of important inequalities that will be used later in the proof of the existence of the solution, the existence of global attractor and the convergence to the conserved phase-field model.
We assume that
(4.1)
for fixed positive constants
and
, which yields, owing to (3.12),
(4.2)
We start with the following proposition.
Proposition 4.1 Any sufficiently regular solution to (2.1)-(2.5) satisfies the following estimates:
(4.3)
and
(4.4)
Proof. The estimates below will be formal, but they can easily be justified within, e.g., a standard Galerkin scheme.
We multiply (3.6) by
and have, integrating over
and by parts,
Noting that, owing to (2.2),
(4.5)
and
we thus deduce from the above that
(4.6)
We then multiply (2.3) by
to obtain
(4.7)
The sum of (4.6) and (4.7) gives, setting
the differential equality
(4.8)
i.e., the decay of the total free energy.
We now multiply (3.6) by
and have, owing to (3.2), (2.10) and (4.2),
(4.9)
We next multiply (3.6) by
and find, owing to (2.8),
(4.10)
Noting that, owing to (2.2),
we have
and we find
(4.11)
which gives
(4.12)
Writing now, in view of (2.2),
we deduce from (4.10) that
(4.13)
Summing (4.8),
times (4.9) and (4.13), where
is small enough, we obtain, setting
an inequality of the form
(4.14)
where
satisfies
(4.15)
In particular, it follows from (4.14)-(4.15) and Gronwall’s lemma the dissipative estimate (4.3) and (4.4), where
Remark 4.1. When
, then we have
and (4.8) reads:
(4.16)
where
which is precisely the energy decay for the classical conserved phase-field model (see [17]).
5. Well-Posedness and Semigroup
In this section we consider that
is fixed. We have the following.
Theorem 5.1. Let
be given. We assume that (2.6) holds,
and
. Then, (2.1)-(2.5) possesses a unique weak solution
such that
and
Furthermore,
,
and
where the index
denotes the weak topology.
Proof. Existence: The proof of existence, as well as of further regularity, is based on the above a priori estimates and a proper Galerkin scheme. Furthermore, the continuity results follow from the Lions-Magenes theorem and the Strauss lemma (see, e.g., [18] for details).
We can note that (3.10)-(3.11) is associated with the following weak formulation:
Find
, such that
(5.1)
(5.2)
(5.3)
Let
be eigenvectors of the minus Laplace operator associated with Neumann boundary conditions; these eigenvectors are associated with the eigenvalues
,
and acting on functions with null spatial average. We assume that the
are orthonormal in
and orthogonal in
.
We set for
,
Actually, here, the only difficulty is to prove the existence of a local in time solution to an approximated problem. To do so, keeping the same notation as in the previous section, we consider the following approximated problem, for
given:
Find
, such that
(5.4)
(5.5)
(5.6)
where
(5.7)
(5.8)
being the orthogonal projector onto
(for the
-norm).
The existence of a local in time solution to (5.4)-(5.8) then follows from the Cauchy-Lipschitz theorem. Having this, we can pass to the limit in a standard way, owing to the above a priori estimates (which also hold at the approximated level) and standard Aubin-Lions compactness results, and deduce the existence of a solution.
Uniqueness: Let
and
be two solutions with initial data
and
, respectively, such that
and
,
. We set
and have
(5.9)
(5.10)
(5.11)
(5.12)
(5.13)
(5.14)
We multiply (5.9) by
and have, owing to (2.8),
(5.15)
Next, multiplying (5.11) by
, we find
(5.16)
Summing finally
times (5.15) and (5.16), where
is small enough, we find
(5.17)
where
Note that it follows from (5.10) that
and
We thus deduce that
and (2.6) yields, employing the Poincar-Wirtinger inequality,
(5.18)
Writing next
it follows that, setting
an inequality of the form
(5.19)
satisfies
(5.20)
It follows from (5.19), (5.20) and Gronwall’s lemma that
(5.21)
finally yields the continuous (with respect to the
-norm) dependence on the initial data, as well as the uniqueness, for
.
This yields uniform in time estimates (i.e., on
) on the solutions, as well as the dissipativity of the corresponding solution operators, we set
We have the continuous (with respect to the semigroup
(i.e.,
(identity operator) and
). We then deduce from (4.3) the following theorem.
Theorem 5.2. The semigroup
is dissipative in
, i.e., there exists a bounded set
(called absorbing set) such that, for every bounded set
, there exists
such that
implies
.
We thus deduce from standard results the following theorem.
Theorem 5.3. The semigroup
possesses the connected global attractor
such that
is compact in
, verifying:
1.
is invariant, i.e.,
;
2.
attracts all bounded sets of initial data in the following sense:
bounded,
as
,
where dist denotes the Hausdorff semi-distance between sets defined by
(we refer the reader to, e.g., [18] for more details.)
The next step would be to study the existence of finite-dimensional attractors for ,
,
, and their stability with respect to
, as well as their convergence to (proper
liftings of) those corresponding to
as
. In particular, one interesting and important problem would be to construct a robust (i.e., both upper and lower semicontinuous as
) family of exponential attractors, meaning that the dynamics of the original and limit problems are close in some proper sense. This will be addressed elsewhere. We also refer the interested reader to, e.g., [19] for discussions on such objects.
6. Convergence to the Classical Conserved Phase-Field Model
Our aim in this section is to pass to the limit in (2.1)-(2.5) as
goes to
. Note that the limit problem for
corresponds to the classical conserved phase-field model,
(6.1)
(6.2)
(6.3)
(6.4)
(6.5)
To do so, we first need to derive estimates on the solutions to (2.1)-(2.5) which are independent of
(we consider here strong solutions as given in Theorem 5.1). We thus consider the initial and boundary value problem
(6.6)
(6.7)
(6.8)
(6.9)
(6.10)
Repeating, for (6.6)-(6.10), the estimates leading to (4.14), we obtain
(6.11)
where
and
(6.12)
We can now prove the following.
Theorem 6.1. We assume that the assumptions of Theorem 5.1 hold. Then, the sequence of solutions
to (6.6)-(6.10) converges to a solution to (6.1)-(6.5) on finite time intervals
,
, as
.
Proof. It follows from the uniform (with respect to
) a priori estimates derived and standard Aubin-Lions compactness results that, at least for a subsequence that we do not relabel, there exist
and
such that, in particular,
and
For a proper
, which implies that
Therefore,
in
weakly, which is sufficient to pass to the limit in the weak formulation.
Having this, it is now standard to pass to the limit in (6.6)-(6.10) to find, at the limit,
(6.13)
(6.14)
(6.15)
i.e.,
is solution to the classical conserved phase-field model.
Noting finally that the solution to the classical conserved phase-field model (6.1)-(6.5) is unique, we see that the whole sequence
converges.
We can also derive error estimates and prove the following.
Theorem 6.2. Under the assumptions of Theorem 6.1, then,
,
Proof. We set
. Note that
(6.16)
Furthermore,
solves
(6.17)
(6.18)
(6.19)
(6.20)
(6.21)
Multiplying (6.17) by
, we obtain, owing to (2.8),
(6.22)
Note that, employing the interpolation inequality
we can write, owing to (6.18),
(6.23)
Moreover, employing again (6.18), we can see that
(6.24)
It thus follows from (6.22) to (6.24) that
which yields, employing Young’s inequality,
(6.25)
Let us next multiply (6.19) by
to obtain
(6.26)
Summing (6.25) and
times (6.26), we find
(6.27)
where
(6.28)
Applying Gronwall’s lemma to (6.27), owing to (6.28) leads to
Integrating next (6.11) over
, we find
which finishes the proof.
Remark 6.1. According to (2.2), the error estimate on
implies the error estimate on
.
7. Numerical Simulations
As far as the numerical simulations are concerned, we use a P1-finite element for the space discretization, together with a semi-implicit Euler time discretization (i.e., implicit for the linear terms and explicit for the nonlinear ones). The numerical simulations are performed with the software Freefem++ [20]. In the simulations below, we set
and we choose
. The triangulation
is obtained by dividing
into 100 × 100 rectangles and by dividing each rectangle along the same diagonal. We set
. The time step is taken as
.
In order to simulate a spinodal decomposition, the initial data
is taken as the projection onto
of a randomly distributed function between 0.5 and 0.7. The solution
is denoted by
.
The full discretization scheme of (2.1)-(2.4) reads: Then, for
, we look for
such that:
(7.1)
for all
.
Figure 1 corresponding to the fixed parameter
, show the evolution of
, first part of the numerical solution
to (7.1), at different times
(
),
(
).
Figure 2 and Figure 3 correspond to the numerical solution
at time
(
), for different values of
:
,
,
,
. It illustrates the fact that, as
tends to 0, the solution
tends to the solution of the classical conserved phase-field model (corresponding to the trivial case
).
Figure 1.
with
; at time
(left),
(right).
Figure 2.
at time
; when
(left),
(right).
Figure 3.
at time
; when
(left),
(right).
8. Conclusion
In this article, we proposed a conserved phase-field model based on microconcentrations. In particular, we proved the existence and uniqueness of solutions, as well as the convergence to the classical conserved phase-field model and the existence of the global attractor. Furthermore, we obtained some numerical simulations.
Acknowledgements
The authors wish to thank an anonymous referee for her/his careful reading of the article and useful comments.