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8/10/2019 Mechanics of Materials Volume 43 issue 10 2011 [doi 10.1016_j.mechmat.2011.06.013] Kamran A. Khan; Romina
1/18
Coupled heat conduction and thermal stress analysesin particulate composites
Kamran A. Khan a, Romina Barello b, Anastasia H. Muliana a,, Martin Lvesque b
a Department of Mechanical Engineering, Texas A&M University, USAb CREPEC, Department of Mechanical Engineering, Ecole Polytechnique de Montreal, Canada
a r t i c l e i n f o
Article history:
Received 2 May 2010
Received in revised form 15 April 2011
Available online 13 July 2011
Keywords:
Heat conduction
Thermal stresses
Particulate composites
Finite element
Micromechanical model
a b s t r a c t
This study introduces two micromechanical modeling approaches to analyze spatial vari-
ations of temperatures, stresses and displacements in particulate composites during tran-
sient heat conduction. In the first approach, a simple micromechanical model based on a
first order homogenization scheme is adopted to obtain effective mechanical and thermal
properties, i.e., coefficient of linear thermal expansion, thermal conductivity, and elastic
constants, of a particulate composite. These effective properties are evaluated at each
material (integration) point in three dimensional (3D) finite element (FE) models that rep-
resent homogenized composite media. The second approach treats a heterogeneous com-
posite explicitly. Heterogeneous composites that consist of solid spherical particles
randomly distributed in homogeneous matrix are generated using 3D continuum elements
in an FE framework. For each volume fraction (VF) of particles, the FE models of heteroge-
neous composites with different particle sizes and arrangements are generated such that
these models represent realistic volume elements cut out from a particulate composite.
An extended definition of a RVE for heterogeneous composite is introduced, i.e., the num-
ber of heterogeneities in a fixed volume that yield the same expected effective response for
the quantity of interest when subjected to similar loading and boundary conditions. Ther-
mal and mechanical properties of both particle and matrix constituents are temperature
dependent. The effects of particle distributions and sizes on the variations of temperature,
stress and displacement fields are examined. The predictions of field variables from the
homogenized micromechanical model are compared with those of the heterogeneous
composites. Both displacement and temperature fields are found to be in good agreement.
The micromechanical model that provides homogenized responses gives average values of
the field variables. Thus, it cannot capture the discontinuities of the thermal stresses at the
particlematrix interface regions and local variations of the field variables within particle
and matrix regions.
2011 Elsevier Ltd. All rights reserved.
1. Introduction
The existence of thermal stresses has always been a
subject of discussion when a body is subjected to coupled
heat conduction and mechanical loadings. In composites,
significant thermal stresses can arise due to the mismatch
in the coefficient of thermal expansions (CTEs) of the con-
stituents, affecting their overall performance. The use of
composite materials in structural components requires
understanding the variations in the field variables, such
as stress, strain, temperature and displacement, both at
micro- and macro scales. At the macro scale, composite
structures are often analyzed as homogeneous structures
through the use of effective properties, which allow per-
forming large-scale structural analyses. Composites are
heterogeneous materials that can exhibit large variations
and even discontinuities in the field variables. These
0167-6636/$ - see front matter 2011 Elsevier Ltd. All rights reserved.doi:10.1016/j.mechmat.2011.06.013
Corresponding author.
E-mail address: [email protected](A.H. Muliana).
Mechanics of Materials 43 (2011) 608625
Contents lists available at ScienceDirect
Mechanics of Materials
j o u r n a l h o m e p a g e : w w w . e l s e v i e r . c o m / l o c at e / m e c h m a t
http://dx.doi.org/10.1016/j.mechmat.2011.06.013mailto:[email protected]://dx.doi.org/10.1016/j.mechmat.2011.06.013http://www.sciencedirect.com/science/journal/01676636http://www.elsevier.com/locate/mechmathttp://www.elsevier.com/locate/mechmathttp://www.sciencedirect.com/science/journal/01676636http://dx.doi.org/10.1016/j.mechmat.2011.06.013mailto:[email protected]://dx.doi.org/10.1016/j.mechmat.2011.06.0138/10/2019 Mechanics of Materials Volume 43 issue 10 2011 [doi 10.1016_j.mechmat.2011.06.013] Kamran A. Khan; Romina
2/18
variations and discontinuities at the micro-scale cannot be
captured if one treats composites as homogenous (homog-
enized) materials.
Different types of micromechanical models with simpli-
fied microstructures have been developed to obtain effec-
tive thermal and mechanical properties. The composite
spheres model (Hashin, 1962), the self consistent approach
(Budiansky, 1965 and Hill, 1965); the generalized self
consistent scheme (Christensen and Lo, 1979, 1986), the
Mori-Tanaka model (Mori and Tanaka, 1973), the probabi-
listic approach ofChen and Acrivos (1978), the differential
method (McLaughlin, 1977 and Norris, 1985) are some
examples. Detailed discussion of various micromechanical
models and bounds on the effective mechanical properties
can be found inAboudi (1991), Mura (1987),Nemat-Nas-
ser and Hori (1999). Khan and Muliana (2010) presented
Fig. 1. Schematic diagram of integration of micro-macro scale approach for particulate composites.
Fig. 2. Homogenization of the sub-regions of a composite component.
K.A. Khan et al. / Mechanics of Materials 43 (2011) 608625 609
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a short review of the capabilities and shortcoming of few
analytical and numerical models for effective CTE and
effective thermal conductivity (ETC) of composites. Analyt-
ical expressions for ETC for two-phase composites made of
randomly distributed and dilute concentrations of spheres
in a homogeneous medium are given, for example, by Max-
well (1954), Verma et al. (1991) and Hasselman and John-
son (1987). Expressions for non-dilute concentrations of
spheres are provided by the models ofJeffrey (1973), Davis
(1986) and Sangani and Yao (1988). These models lead to
accurate ETC predictions, when compared to experimental
results, when the volume fraction (VF) is relatively small or
when the conductivities of the constituents are compara-
ble (Matt and Cruz, 2002). Bounds on the effective thermal
conductivity have been derived using variational principle
(Hashin and Shtrikman, 1962; Beran, 1965) and three point
probability function for the distribution of microstructures.
Several numerical modeling approaches have been
developed to estimate effective thermal and mechanical
behavior of a composite. To obtain effective heat conduc-
tion response and ETC of a composite the composites are
often described with random microstructures (Ostoja-Star-
zewski and Schulte, 1996; Nogales and Bohm, 2008) as
well as with periodic microstructures (Auriault, 1983; Ver-
ma et al., 1991; Jiang et al., 2002). Real composite micro-
structures are generally non periodic; however, the use
of periodic microstructures can give approximate effective
properties for a smaller computational cost when com-
pared to that of random microstructures. To obtain the
effective thermo-mechanical response, among the numer-
ical methods, the Finite Element (FE) technique has been
used for determining the micro- and macro-structural per-
formance of composites by meshing their detailed micro-
structures; see for example the works of Llorca and
Segurado (2002, 2003 and 2006), Lvesque et al. (2004,
2008) and Zohdi and Wriggers (2001). The composite
behavior was obtained from simulations of a 3D cubic Rep-
resentative Volume Element (RVE) containing several ran-
domly distributed non-overlapping identical spheres.
Periodic boundary conditions were imposed on the meshes
in order to obtain the effective properties. Linearly elastic,
elasticplastic and linearly (Lvesque and Barello, 2009)
and nonlinearly viscoelastic (Lvesque et al. 2004) re-
sponses were analyzed. Kwon and Kim (1998) developed
a 3D micromechanical model to compute thermal stresses
of particulate composites. Using a similar type of microme-
chanical model, Meijer et al. (2000) studied the influence of
inclusion geometry and thermal residual stresses- and
strains on the mechanical behavior of an aluminum alloy
reinforced with aluminum oxide particles. A unit-cell con-
sisting of eight subcells was considered. One cell repre-
sents the particle and the rest of the cells surrounding
the particle were considered as matrix. Both constituents
were assumed to be linearly elastic and the thermal prop-
erties were considered to be temperature independent. The
effects of the size of the subcells on the stresses and strains
Fig. 3. 3D FE models of (a) homogenized and (b) heterogeneous composites. (c) Schematic of thermal and mechanical loading directions and profiles along
which field variables are evaluated, i.e., AB, CD, EF and GH.
Table 1
Temperature dependent mechanical and physical properties of materials of Ti6Al4V and ZrO 2used in 3D FE analyses.
Property Ti6Al4V Zirconia (Zr02)
Young modulus (E) (Pa) 1.23 101156.46 106T 2.44 1011334.28 106T+ 295.24 103T2 89.79T3
Poisson ratio (t) 0.3 0.3Coefficient of thermal expansion (a)106,
1/K
7.58 106 + 4.93 109
T+ 2.39 1012 T21.28 105 19.07 109 T+ 1.28 1011
T2 8.67 1017 T3
Thermal conductivity, (k), W/m/K 1.21 + 0.0169T 1.7+ 2.17 104 T+ 1.13 105 T2
Specific heat (c), J/kg K 625.297 0.264T+ 4.49 104 T2 487.343 + 0.149T 2.94 105 T2
Density (q), kg/m3 4429 5700
T is temperature in Kelvin (K).
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were analyzed. It was found that the sharp corner and
edges of the cube resulted in localized stresses and strains.
Recently, Aboudi (2008)presented a micromodel for fully
coupled thermo-mechanical analysis for multiphase com-
posites where heat generation from the interconvertibility
of the mechanical and thermal energy was accounted for.
This study focuses on understanding the effects of con-
stituents properties and microstructural details on the
variation of stress, displacement and temperature in com-
posites. The results are used to justify the capability of
micromechanical models to analyze the overall response
of composites subjected to simultaneous mechanical and
thermal stimuli, within a certain degree of accuracy. A
simplified micromechanical model for predicting the effec-
tive thermo-mechanical behavior of particulate composites
subjected to both time and space varying temperature field
is introduced. The micromechanical model is called at each
integration point in a FE mesh to calculate thelocal effective
properties of the composite. The responses thus obtained
are then compared to FE simulations of composites using
the meshes ofBarello and Lvesque (2008). A sequentially
thermo-mechanical coupled problem, i.e., the temperature
field influences the deformation field, is considered. The
effects of particle volume contents and temperature depen-
dent constituent properties on the overall thermo-elastic
behavior of the composites are examined.
The paper is organized as follows. A brief outline of the
simplified micromechanicalmodel is presented in Section2.
The effective thermoelastic stress-strain relations, effective
heat flux equation and uncoupled energy equation for an
isotropic homogenized composite are also discussed.
Section 3 presents a micro-mechanical framework used
for computing the response of a real-size composite. FE
modeling of composites with microstructural details is
given in Section4. Coupled heat conduction and thermal
stress analysis of particulate composites are discussed in
Section5. A summary of the research findings is given in
Section6.
2. A simplified micromechanical model for particle
reinforced composites
Muliana and Kim (2007), Muliana (2008) and Khan and
Muliana (2010) developed a micromechanical model for
determining the effective viscoelastic responses and
300
400
500
600
700
Temperature(K)
Temperature(K)
a
t =12s
t=26s
t=2s
Steady State Time = 150 seconds
Detail Microstructural Model
Micromechanical Model(CPU Time = 277s)
Model-1 (CPU Time = 12785s)
Model-2 (CPU Time = 13386s)
Model-3 (CPU Time = 12481s)
Model-4 (CPU Time = 12519s)
Model-5 (CPU Time = 12152s)
Model-6 (CPU Time = 11319s)
(Volume fraction = 20%, 20 particles)
b
0 2 4 6 8 10
Distance (mm) Distance (mm)
300
400
500
600
700
300
400
500
600
700
Temperature(K)
Temperature(K)
300
400
500
600
700
t=12s
t =26s
t=2s
Detail Microstructural Model
Micromechanical Model
Model-1
Model-2
Model-3
Model-4
(Volume fraction = 20%, 40 particles)
t=12s
t=26s
t =2s
Detail Microstructural Model (Volume fraction = 20%, 20 particles)
Micromechanical Model
c
0 2 4 6 8 10
0 2 4 6 8 10
Distance (mm) Distance (mm)0 2 4 6 8 10
t=12s
t=26s
t=2s
Detail Microstructural Model
Micromechanical Model
(Volume fraction = 20%, 40 particles)
d
Fig. 4. Comparison of temperature profiles for FE models with the unit cell (micromechanical model) at each integration point (solid line) and the FEmodels with 3D microstructural detail (symbols) for volume fraction of 20%. (a) and (b) are actual values of temperature at top (corner) edge {( X1, 10, 10);
06X1 6 10}, (c) and (d), mean value of temperatures of different FE models measured at extreme top and bottom (corner) edges of the cubes along the
temperature gradient direction..
K.A. Khan et al. / Mechanics of Materials 43 (2011) 608625 611
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thermal properties (CTE, and thermal conductivity) of a par-
ticle reinforced polymer composite. The model is modified
for simulating sequentially coupled heat conduction and
deformation in particulate composites. The model idealizes
particles in the microstructure as cubes. The cubic particles
are arranged uniformly in a homogeneous matrix. The RVE
is defined as a single particle embedded in a cubic matrix.
Periodic boundary conditions are imposed to the RVE. Due
to the three-plane symmetry, a unit-cell model thatconsists
of four particle and matrix subcells is considered. Fig. 1
t =12s
t=26s
t =2s
Detail Microstructural Model
Micromechanical Model
Model-1
Model-2
Model-3
Model-4
(Volume fraction = 30%, 15 particles)
t =12s
t=26s
t=2s
Detail Microstructural Model
Micromechanical Model
Model-1
Model-2
Model-3
Model-4
(Volume fraction = 30%, 30 particles)
t =12s
t =26s
t =2s
Detail Microstructural Model
Micromechanical Model
Model-1
Model-2
Model-3
Model-4
(Volume fraction = 30%, 45 particles)
t=12s
t =26s
t= 2s
Detail Microstructural Model
Micromechanical Model
(Volume fraction = 30%, 15 particles)
t=12s
t=26s
t =2s
Detail Microstructural Model
Micromechanical Model
(Volume fraction = 30%, 30 particles)
t=12s
t=26s
t=2s
Detail Microstructural Model
Micromechanical Model
(Volume fraction = 30%, 45 particles)
300
400
500
600
700
Temperature(K)
a
300
400
500
600
700
Temperature(K)
d
0 2 4 6 8 10
Distance (mm)0 2 4 6 8 10
Distance (mm)
300
400
500
600
700
T
emperature(K)
b
300
400
500
600
700
T
emperature(K)
e
0 2 4 6 8 10
Distance (mm)0 2 4 6 8 10
Distance (mm)
300
400
500
600
700
Temperature(
K)
c
300
400
500
600
700
Temperature(K)
f
0 2 4 6 8 10
Distance (mm)0 2 4 6 8 10
Distance (mm)
Fig. 5. Comparison of temperature profiles for FE models with the unit cell (micromechanical model) at each integration point (solid line) and the FE
models with 3D microstructural detail (symbols) for volume fraction of 30%. (a), (b) and (c) are actual values of temperature at top (corner) edge{(X1, 10,
10); 06X1 6 10}, (d), (e) and (f), mean value of temperatures of different FE models measured at extreme top and bottom(corner) edges of the cubes alongthe temperature gradient direction.
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shows the RVE idealization, unit-cell and its integration
with the FE framework. The choice of the four-cell model
was primarily done to reduce computational costs; how-
ever, this turned out to cause extra effort in incorporating
material symmetry. It is noted that the chosen unit-cell
model, which is only one-eighth of the full model, was
due to the threeplanes of symmetrythat allows interchang-
ing the principal axes in formulating the stress, strain, tem-
perature gradient and heat flux quantities. As a result, the
unit-cell response is independent of the loading direction.
When both particle and matrix are isotropic, the outcome
of the homogenized micromechanical model does not
always fulfill the isotropic condition with regard to the
mechanical response. The micromechanical formulation
has been discussed in detail elsewhere (Muliana and Kim,
2007). Perfect bonds are assumed along the subcells inter-
faces. Thermo-elastic constitutive models with tempera-
ture dependent material parameters are used for both
isotropic constituents. Linearized micromechanical rela-
tions are formulated in terms of incremental average field
variables, i.e., stress, strain, heat flux and temperature
gradient, of the subcells. The effective CTE is derived by sat-
isfying total displacement compatibility and traction conti-
nuity at the interfaces during thermo-elastic deformations.
This formulation leads to an effective temperature-depen-
dent CTE. The effective thermal conductivity is formulated
by imposing heat flux and temperature continuities at the
subcells interfaces. This micromechanical model is
compatible with general displacement based FE software,
which can be used to perform thermo-mechanical analyses
of composites structures.
For linearly thermo-elastic problems, the effective
stress (rij) and strain (eij) are related through:
rij Cijklekl aklT T0 1
or
eij Sijklrkl aijT T0 2
whereCijkl and Sijkl are the components of the effective elas-
tic stiffness and compliance tensors, respectively. The aklare the components of the effective CTE tensor. The param-
eters TandT0 are the effective current and reference tem-
peratures, respectively.
The average heat flux equation for a homogeneous com-
posite medium is expressed by Fouriers law of heat con-
duction as:
qi Kij uj; where uj @T
@xj3
where qi and uj are the components of the average heatflux and temperature gradient vectors, respectively. In or-
der to obtain the temperature profiles during heat conduc-
tion in the composite, the energy equation needs to be
solved. For the thermo-elastic case, in the absence of inter-
nal heat generation and thermo-mechanical coupling ef-
fect, the energy equation can be written as:
qcxk_T qi;i i; k 1; 2; 3 4
whereq
cx
kis the effective heat capacity that depends on
the composition, density and specific heat of the two
constituents in the composite body. The effective heat
capacity is obtained using a volume average method.
The linearized thermo-elastic constitutive equations are
expressed in an incremental form. A macroscopic strain
and temperature gradient are known and used as input
variables to the micromechanical formulation. The current
microscopic strain and temperature gradient are expressed
as etij
etDtij
detij
anduti
utDti
duti
, respectively. For
simplicity, the superscript t indicating current time, will
be dropped. The macroscopic incremental strain (dekl) islinked to the average incremental strain of each sub-cell
(deaij ) using the strain concentration tensor (Baijkl), written
as
dea
ij Ba
ijkldekl 5
Similarly, the average temperature gradient in each
subcell duai ) is related through to overall temperaturegradient (d uj) by the concentration tensor (M
aij ), written
as
dua
i M
a
ij duj 6
where superscript (a) denotes the subcell number, i.e.,a = 1, 2, 3, 4. The strain concentration tensor (Baijkl) is
t=8s
t =26s
t=2s
Detail Microstructural Model (Volume fraction = 30%)
15 particles
30 particles
t=12st=18s
45 particles
t=8s
t=26s
t=2s
Detail Microstructural Model (Volume fraction = 20%)
20 particles
40 particles
t =12s
t=18s
300
400
500
600
700
Tem
perature(K)
a
0 2 4 6 8 10
Distance (mm)
300
400
500
600
700
Temperature(K
)
b
0 2 4 6 8 10
Distance (mm)
Fig. 6. Mean temperature profiles for FE models with the unit cell
(micromechanicalmodel) at each integration point (solid line) and the FE
models with 3D microstructural detail (symbols) for volume fraction of(a) 20% and (b) 30%.
K.A. Khan et al. / Mechanics of Materials 43 (2011) 608625 613
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determined by imposing the constitutive relation of each
subcell and micromechanical relations such that the dis-
placement compatibility and traction continuity condi-
tions are satisfied. Two sets of equations are formed. The
first set of the equations are determined from the strain
compatibility equations which are given as:
fReg121
AM11224
e1
e2
e3
e4
8>>>>>:
9>>>=>>>;
241
DM1126
feg61
7
where {Re} is the strain residual vector. The second set of
the equations satisfies the traction continuity relations
within subcells:
fRrg121
AM21224
e1
e2
e3
e4
8>>>>>:
9>>>=
>>>;241
O126
feg61
8
where {Rr} is the stress residual vector. The matrixO is the
zero matrix and the components of matrix AM1 ;A
M2 andD
M1
can be found elsewhere (Muliana and Kim, 2007). For lin-
earized elasticity problems, the components of the residual
vectors are zero and thus the micromechanical relations
are exactly satisfied. When any of the constituents exhibit
nonlinear response, imposing linearized micromechanical
relations leads to non-zero residual vectors {Re} and {Rr}.
The Newton Raphson iterative method is used to minimize
these residual vectors. Upon minimizing the residual, the
strain concentration matrixB(a) is obtained from:
Ba;t246
A
M1
AM2
" #12424
DM1
O
" #246
9
To formulate the concentration tensor, Maij ;the micro-
mechanical relations and the constitutive equations for
heat flux are imposed. This requires forming twelve (12)
equations based on the temperature and heat flux continu-
ities at the interface of each subcell as:
-0.005
0
0.005
0.01
0.015
Di
splacement(mm)
t=26s
t=12s
t=2s
Steady State Time = 150 seconds
Micromechanical Model
Model-1
Model-2
Model-3
Model-4
Model-5
Model-6
a
-0.005
0
0.005
0.01
0.015
Displacement(mm)
t=26s
t=12s
t=2s
Micromechanical Model
Model-1
Model-2
Model-3
Model-4
b
-0.005
0
0.005
0.01
0.015
Displacement(mm)
t=12s
t=26s
t=2s
Detail Microstructural Model
Micromechanical Model
(Volume fraction = 20%, 40 particles)
d
-0.005
0
0.005
0.01
0.015
Displacement(mm)
t =12s
t =26s
t=2s
Detail Microstructural Model
Micromechanical Model
(Volume fraction = 20%, 20 particles)
cDetail Microstructural Model(Volume fraction = 20%, 20 particles)
Detail Microstructural Model (Volume fraction = 20%, 40 particles)
0 2 4 6 8 10
Distance (mm)0 2 4 6 8 10
Distance (mm)
0 2 4 6 8 10
Distance (mm)0 2 4 6 8 10
Distance (mm)
Fig. 7. Comparison of axial displacements for FE models with the unit cell (micromechanical model) at each integration point (solid line) andthe FE models
with 3D microstructural detail (symbols) for volume fraction of 20%.(a) and (b) are actual values of displacements at top (corner) edge {(X1, 10, 10);
06X1 6 10}, (c) and (d), mean value of displacements of different FE models measured at extreme top and bottom (corner) edges of the cubes along thetemperature gradient direction.
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fRug91
AT1912
du1
du2
du3
du4
8>>>>>:
9>>>=>>>;
121
DT193
fd ug31
10 fRqg31
AT2312
du1
du2
du3
du4
8>>>>>:
9>>>=>>>;
121
O33
fdug31
11
-0.005
0
0.005
0.01
0.015
0.02
Displacement(mm)
t =26s
t =12s
t =2s
Detail Microstructural Model
Micromechanical Model
Model-1
Model-2
Model-3
Model-4
-0.005
0
0.005
0.01
0.015
0.02
Displacement(mm)
t =26s
t=12s
t=2s
Detail Microstructural Model
Micromechanical Model
Model-1
Model-2
Model-3
Model-4
-0.005
0
0.005
0.01
0.015
0.02
Displacement(mm)
t=26s
t =12s
t=2s
Detail Microstructural Model
Micromechanical Model
Model-1
Model-2
Model-3
Model-4
-0.005
0
0.005
0.01
0.015
0.02
Displacement(mm)
t=12s
t=26s
t=2s
Detail Microstructural Model
Micromechanical Model
(Volume fraction = 30%, 15 particles)(Volume fraction = 30%, 15 particles)
-0.005
0
0.005
0.01
0.015
0.02
Displacement(mm)
t=12s
t=26s
t=2s
Detail Microstructural Model
Micromechanical Model
(Volume fraction = 30%, 30 particles)
(Volume fraction = 30%, 30 particles)
-0.005
0
0.005
0.01
0.015
0.02
Displacement(
mm)
t=12s
t=26s
t=2s
Detail Microstructural Model
Micromechanical Model
(Volume fraction = 30%, 45 particles)
(Volume fraction = 30%, 45 particles)
0 2 4 6 8 10
Distance (mm)0 2 4 6 8 10
Distance (mm)
0 2 4 6 8 10
Distance (mm)0 2 4 6 8 10
Distance (mm)
0 2 4 6 8 10
Distance (mm)0 2 4 6 8 10
Distance (mm)
a d
b e
c f
Fig. 8. Comparison of axial displacements for FE models with the unit cell (micromechanical model) at each integration point (solid line) and the FE models
with 3D microstructural detail (symbols) for volume fraction of 30%. (a), (b) and (c) are actual values of displacements at top (corner) edge {( X1, 10, 10);
06X1 6 10}, (d), (e) and (f), mean value of displacements of different FE models measured at extreme top andbottom(corner) edges of the cubes along thetemperature gradient direction.
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where {R/} and {Rq} are the temperature gradient and heat
flux residual vectors, respectively. By substituting Eq. (6)
into Eqs.(10) and (11), theM(a) matrix can be determined
as:
Ma121
A
T1
AT2
" #11212
DT1
O
" #121
12
where AT1, A
T2 andD
T1 can be found elsewhere (Khan and
Muliana, 2009). The effective (homogenized) stress and
effective tangent stiffness matrix can be obtained from
the following equations:
rij1
V
X4a1
VaCa
ijklBa
klrsers a
a
kl DT Cijklekl aklDT 13
Cijkl1
V
X4a1
VaCa
ijklB
a
klrs 14
whereVandV(a) are the total volume of the unit-cell mod-
el and sub-cell volume, respectively. From Eq. (13), theeffective CTE, (aij) can be obtained and written as:
aijC1ijklV
X4a1
VaCa
klmnaamn 15
Using the heat conduction equation for each sub-cell
and the effective heat flux relation (Eq. (3)), the tangent
effective thermal conductivity matrix of the composite
can be expressed as:
Kik 1
V
X4a1
VaKa
ij Ma
jk 16
3. A multi-scale model for computing the response of a
homogenized composite
The micro-mechanical model of Section 2 has been inte-
grated into a multi-scale FE framework in order to com-
pute the field variables of a real-size composite.
Boundary conditions are imposed on the real-size compos-
ite model and initial values of the field variables are as-
sumed. Local effective properties (thermal, mechanical)
are computed at each integration point using the micro-
mechanical model. Computations of the effective proper-
ties are based on the assumption that the each integration
point is associated with a much smaller volume than that
of the whole composite. As a result, we assumed that each
volume associated with each integration point was at a
uniform temperature. Therefore, at the micro-scale, both
the matrix and reinforcement were assumed to be at the
same temperature. This allows determining temperature-
dependent thermal conductivities for the particle and ma-
trix constituents and calculating the effective thermal con-
ductivities of the composite at that instant of time in each
material point. Therefore, in this context, the periodic
boundary conditions are fully justified for obtaining the
effective properties. At macroscopic scale during the tran-
sient heat conduction, the temperature-dependent proper-
ties of the constituents lead to spatially dependent ETC.
To simulate the effective thermo-elastic response of the
particulate composite, the micromechanical model is inte-
grated with the ABAQUS/standard FE code. At each integra-
tion point in the FE mesh, the user subroutine UMATH is
first called to evaluate the effective thermal conductivity,
heat fluxes, and temperature gradient for solving the equa-
tion that governs the conduction of heat in the composite
body. The temperature distributions obtained from heat
transfer analyses at various instants of time in the compos-
ites are used as input transient thermal load to determine
the thermo-elastic deformation in the composite body.
UMAT and UEXPAN subroutines were used to evaluate
the effective mechanical response and CTE, respectively.
Fig. 1illustrates the whole multi-scale framework.
4. Three dimensional FE models of particulate
composites
4.1. General methodology for evaluating the performance of
the multi-scale framework
The multi-scale model of Section 3 can be considered as
an approximation to a complicated thermo-mechanical
-0.005
0
0.005
0.01
0.015
Displacement(m
m)
t =12s
t=26s
t=2s
Detail Microstructural Model (Volume fraction = 30%)
15 particles
b
30 particles
45 particles
-0.005
0
0.005
0.01
0.015
Disp
lacement(mm)
t=12s
t=26s
t=2s
Detail Microstructural Model (Volume fraction = 20%)
20 particles
a
40 particles
0 2 4 6 8 10
Distance (mm)
0 2 4 6 8 10
Distance (mm)
Fig. 9. Mean displacement profiles for FE models with the unit cell
(micromechanical model) at each integration point (solid line) and the FE
models with 3D microstructural detail (symbols) for volume fraction of(a) 20% and (b) 30%.
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problem: the problem of computing the temperature and
stresses inside a heterogeneous material subjected to both
thermal and mechanical loads. In order to evaluate the
reliability of the micro-mechanical model, it is therefore
required to compare its predictions against the numeri-
cally exact solution. The objective of this section is to
generate this so called numerically exact solution.
When dealing with effective properties, one of the key
issues is the definition of the RVE. A RVE can be seen as a
volume of material having the same behavior as any larger
volume of the same material. The size of the RVE is mea-
sured in terms of inhomogeneities it contains (e.g. the
number of particles meshed, like 5, 10, 15, etc., particles).
One of the techniques used for obtaining the RVE size is
to use numerical homogenization based on FE. The method
consists in generating many FE meshes of the composite
microstructure with a fixed number of reinforcements
(10, 15, 50, etc.). Since the particles are distributed accord-
ing to a statistical distribution, each mesh, or realization,
will be different. Therefore, each realization should lead
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0
200
400
AxialStresses(
11
)MPa
t=2s
Detail Microstructural Model
Micromechanical Model
Model-1
Model-2
Model-3
Model-4
Model-5
Model-6
(Volume fraction = 20%, 20 particles)
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0
200
400
AxialStresses(
11
)MPa
t=12s
Detail Microstructural Model
Micromechanical Model
Model-1
Model-2
Model-3
Model-4
Model-5
Model-6
(Volume fraction = 20%, 20 particles)
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0
200
400
AxialStresses(
11
)MPa
t=26s
Detail Microstructural Model
Micromechanical Model
Model-1
Model-2
Model-3
Model-4
Model-5
Model-6
(Volume fraction = 20%, 20 particles)
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0
200
400
AxialStresses(
11
)MPa
t
=2s
Detail Microstructural Model
Micromechanical Model
Model-1
Model-2
Model-3
Model-4
(Volume fraction = 20%, 40 particles)
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0
200
400
AxialStresses(
11
)MPa
t=12s
Detail Microstructural Model
Micromechanical Model
Model-1
Model-2
Model-3
Model-4
(Volume fraction = 20%, 40 particles)
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-200
0
200
400
AxialStresses(
11
)MP
a
t=26s
Detail Microstructural Model
Micromechanical Model
Model-1
Model-2
Model-3Model-4
(Volume fraction = 20%, 40 particles)
0 2 4 6 8 10
Distance (mm)0 2 4 6 8 10
Distance (mm)
0 2 4 6 8 10
Distance (mm)
0 2 4 6 8 10
Distance (mm)
0 2 4 6 8 10
Distance (mm)
0 2 4 6 8 10
Distance (mm)
a d
b e
c f
Fig. 10. Axial thermal stresses for FE models with the unit cell (micromechanical model) at each integration point (solid line) and the FE models with 3Dmicrostructural detail (symbols) for volume fraction of 20% at different times.
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to different (within certain accuracy) effective properties.
For the same number of reinforcements and load history,
the effective responses are computed for each realization
and then averaged. Computing a confidence interval (for
example a two-tail 95% confidence interval) on this data
could give an estimation of the composites effective prop-
erties and its precision for a given number of reinforce-
ments. The relative precision (for example the Youngs
modulus is estimated to bexy%) can be adjusted by vary-
ing the number of realizations. If many realizations are
performed, the confidence interval can be adjusted to the
desired width. Kanit et al. (2003) mentioned that for
microstructures containing numerous reinforcements,
smaller numbers of realizations are required to estimate
0 2 4 6 8 10
Distance (mm)
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0
100
200
300
400
AxialStresses(
11
)MPa
t=2s
Detail Microstructural Model (Volume fraction = 20%, 20 particles)
Micromechanical Model
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-200
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0
100
200
300
400
Axial
Stresses(
11
)MPa
t =12s
Detail Microstructural Model (Volume fraction = 20%, 20 particles)
Micromechanical Model
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-200
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0
100
200
300
400
AxialStresses(
11
)MPa
t=26s
Detail Microstructural Model (Volume fraction = 20%, 20 particles)
Micromechanical Model
0 2 4 6 8 10
Distance (mm)
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-200
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0
100
200
300
400
AxialStresses(
11
)MPa
t=2s
Detail Microstructural Model (Volume fraction = 20%, 40 particles)
Micromechanical Model
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-200
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0
100
200
300
400
AxialStresses(
11
)MPa
t=12s
Detail Microstructural Model (Volume fraction = 20%, 40 particles)
Micromechanical Model
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-200
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0
100
200
300
400
AxialStresses(
11
)MPa
t=26s
Detail Microstructural Model (Volume fraction = 20%, 40 particles)
Micromechanical Model
0 2 4 6 8 10
Distance (mm)0 2 4 6 8 10
Distance (mm)
0 2 4 6 8 10
Distance (mm)0 2 4 6 8 10
Distance (mm)
a d
b e
c f
Fig. 11. Axial thermal stresses for FE models with the unit cell (micromechanical model) at each integration point (solid line) and the FE models with 3D
microstructural detail (symbols) for volume fraction of 20% at different times with C.I. of 95%. (a), (b) and (c) are mean value of stresses of different FE
models with 20 particles and (d), (e) and (f) with 40 particles, measured at extreme top and bottom (corner) edges of the cubes along the temperaturegradient direction.
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the wanted overall property within desired precision. For
relatively small numbers of particles, the homogenized
properties vary statistically until a certain number of par-
ticles are meshed. The number of particles after which
the effective response does not change anymore is called
the representative volume element.
In this work, emphasis was put on field variables distri-
butions rather than on effective properties. For illustration
purposes, consider a macroscopic component made of a
nonlinear composite constituted of many reinforcements,
as shown in Fig. 2(a). Consider that the component is di-
vided into many sub-regions of length l(Fig. 2(b)). For each
(Volume fraction = 30%,, 15 particles)
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200
400
AxialStresses(
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)MPa
t=2s
Detail Microstructural Model
Micromechanical Model
Model-1
Model-2
Model-3
Model-4
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0
200
400
AxialStresses(
11
)MPa
t=2s
Detail Microstructural Model
Micromechanical Model
Model-1
Model-2
Model-3
Model-4
(Volume fraction = 30%,, 30 particles)
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0
200
400
AxialStresses(
11
)MPa
t=2s
Detail Microstructural Model
Micromechanical Model
Model-1
Model-2
Model-3Model-4
(Volume fraction = 30%, 45 particles)
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0
200
400
AxialStresses(
11
)MPa
(Volume fraction = 30%,, 15 particles)
t=12s
Detail Microstructural Model
Micromechanical Model
Model-1
Model-2
Model-3
Model-4
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0
200
400
AxialStresses(
11
)MPa
t =12s
Detail Microstructural Model
Micromechanical Model
Model-1
Model-2
Model-3
Model-4
(Volume fraction = 30%,, 30 particles)
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-200
0
200
400
AxialStresses(
11
)MP
a
t=12s
Detail Microstructural Model
Micromechanical Model
Model-1
Model-2
Model-3Model-4
(Volume fraction = 30%, 45 particles)
0 2 4 6 8 10
Distance (mm)0 2 4 6 8 10
Distance (mm)
0 2 4 6 8 10
Distance (mm)0 2 4 6 8 10
Distance (mm)
0 2 4 6 8 10
Distance (mm)0 2 4 6 8 10
Distance (mm)
a b
c d
e f
Fig. 12. Axial thermal stresses for FE models with the unit cell (micromechanical model) at each integration point (solid line) and the FE models with 3Dmicrostructural detail (symbols) for volume fraction of 30% at different times.
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sub-region, assume that the RVE size has been reached so
that effective properties could be calculated (Fig. 2(c)).
Therefore, the composite component can be divided into a
number of homogeneous sub-regions, as was done in Sec-
tion 3. If the component is subjected to an external loading
(thermal, mechanical, etc.), the effective properties of each
sub-region can be iteratively computed in order to estimate
the field variable distribution into the homogenized com-
ponent. It is recalled that each effective property is known
within a given accuracy and different realization of the
same composite component should lead to different field
variables distributions. As l decreases and the number of
sub-regions increases, the difference in the field variables
distributions between each realization should decrease un-
til an acceptable scatter is reached. Since each sub-region is
constituted of a finite number of reinforcements, there is a
finite number of reinforcements inside the composite com-
ponent for which the homogenized response from one real-
ization to the other stays within a given tolerance. In this
work, the meshed composites are considered as the macro-
scopic components mentioned above. The simulations
performed in Section5 aim at determining the number of
reinforcements required for obtaining field variables distri-
butions corresponding to the homogenized component, as
well as the distribution themselves.
4.2. Generation of the FE meshes used in this study
The FE meshes used in this study are those ofBarello
and Lvesque (2008). Their generation is recalled here.
The detailed composite consists of randomly distributed
identical spherical particles reinforced matrix. The micro-
structures were generated using the Random Sequential
Adsorption Algorithm (Segurado and LLorca, 2002). Thealgorithm consists in generating the position of a first
spherical particle center into a cubic volume using a uni-
form random number generator. Then, the center position
of a second sphere is generated. If the distance between the
centers of the first two particles and the distance from the
particle center from the cubes faces is smaller than a pre-
set value, then the second particle is rejected and a new
center position is generated until the minimum distance
criterion mentioned above is met. The other particles are
sequentially added, following the same process where
the distance criteria are checked with all the existing par-
ticles. The particles are added until the desired volume
fraction is reached.
The particles were allowed to cut the edges and the
faces of the cube. When this happened, the particles were
completed periodically on the corresponding faces and
edges. The realizations thus obtained were therefore peri-
odic and always had an integer number of complete
spheres. The minimum distance between two particles
centers was set to 2.07r, where ris the particle radius while
the minimum distance from a particle center to a cubes
face was set to 0.1r. These distance criteria were obtained
through trial and error with the meshing software until
elements of acceptable aspect ratios were obtained.
A Matlab program was used for generating the particle
centers. This program wrote an ANSYS command file for
generating the FE mesh of the microstructure. Finally, a
Matlab program was used for converting the ANSYS
model to ABAQUS. The mesh consisted of 10-noded
tetrahedra.
5. Simulation execution and results
5.1. Simulations performed in this study
For both the multi-scale framework and the detailed
models of Section 4, cubic models of dimensions10 10 10 mm were used.Fig. 3shows these models as
well as the axes used for defining the boundary conditions
below. The studied composite is a ZrO2 matrix reinforced by
randomly distributed Ti-6Al-4V spherical particles. The
heterogeneous composites directly incorporate nonlinear
thermo-elastic behaviors for the particle and matrix re-
gions. The thermal as well as the mechanical properties
used in the simulations can be found in Khan and Muliana
(2010)and are given inTable 1. Two volume fractions of
reinforcements were studied, namely 20% and 30%. For
the detailed FE meshes, cubes containing 15, 20, 30, 40
and 45 spheres were generated. The transient thermal anal-
ysis consisted in a problem where a composite was initiallyat 300 K, except for one face that was at 600 K. This tran-
sient heat transfer problem was solved until a steady state
was reached. A uniformstress of 10 MPa was applied on the
face that was at 600 K in order to simulate effective tran-
sient thermal stresses. The models were subjected to the
following mixed uniform boundary conditions:
u10;x2;x3; t 0:0; 0 6x2 6 10; 0 6x3 6 10; tP 0
u2x1;0;x3; t 0:0; 0 6x1 6 10; 0 6x3 6 10; tP 0
u3x1;x2;0; t 0:0; 0 6x1 6 10; 0 6x2 6 10; tP 0
p110;x2;x3; t 10:0 MPa; 0 6x2 6 10; 0 6x3 6 10; tP 0
p2x1;10;x3; t 0:0 MPa; 0 6x1 6 10; 0 6x3 6 10; tP 0
p3x1;x2;10; t 0:0 MPa; 0 6x1 6 10; 0 6x2 6 10; tP 0
18
Tx1;x2;x3; 0 300 K; 0 6x1 6 10; 0 6 x2 6 10; 0 6 x3 6 10
T10;x2;x3; t 600 K; 0 6x2 6 10; 0 6 x3 6 10; tP 0
@Tx1; 0;x3; t
@x2
@Tx1; 10;x3; t
@x2 0:0; 0 6x1 6 10; 0 6 x3 6 10; tP 0
@Tx1;x2; 0; t
@x3
@Tx1;x2; 10; t
@x30:0; 0 6x1 6 10; 0 6 x2 6 10; tP 0
17
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whereui and pi (i= 1, 2, 3) are the components of the dis-
placements and the surface tractions, respectively. It is re-
called that the set of boundary conditions affects the size of
the representative volume element, and hence, that of the
representative component. It is therefore expected that the
same component subjected to different boundary condi-
tions requires a different number of heterogeneities in or-
der to lead to converged field variables distributions.
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0
100
200
300
400
AxialStresses(
11
)MPa
t=2s
Detail Microstructural Model(Volume fraction = 30%, 45 particles)
Micromechanical Model
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-200
-100
0
100
200
300
400
AxialStresses(
11
)MPa
t=12s
Detail Microstructural Model(Volume fraction = 30%, 45 particles)
Micromechanical Model
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-300
-200
-100
0
100
200
300
AxialStresses(
11
)MPa
t=2s
Detail Microstructural Model(Volume fraction = 30%, 15 particles)
Micromechanical Model
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-200
-100
0
100
200
300
400
400
AxialStresses(
11
)MPa
t=2s
Detail Microstructural Model(Volume fraction = 30%, 30 particles)
Micromechanical Model
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-200
-100
0
100
200
300
AxialStresses(
11
)MPa
t =12s
Detail Microstructural Model(Volume fraction = 30%, 15 particles)
Micromechanical Model
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-300
-200
-100
0
100
200
300
400
400
AxialStresses(
11
)MPa
t=12s
Detail Microstructural Model(Volume fraction = 30%, 30 particles)
Micromechanical Model
0 2 4 6 8 10Distance (mm) 0 2 4 6 8 10Distance (mm)
0 2 4 6 8 10
Distance (mm)0 2 4 6 8 10
Distance (mm)
0 2 4 6 8 10
Distance (mm)0 2 4 6 8 10
Distance (mm)
a b
c d
e f
Fig. 13. Axial thermal stresses for FE models with the unit cell (micromechanical model) at each integration point (solid line) and the FE models with 3D
microstructural detail (symbols) for volume fraction of 30% at different times with C.I. of 95%. (a), (b) and (c) are mean value of stresses of different FE
models with 15 particles and (d), (e) and (f) with 30 particles, (g), (h) and (i) with 45 particles, measured at extreme top and bottom (corner) edges of thecubes along the temperature gradient direction.
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Due to the boundary conditions, the field variables
distribution on the four cube segments oriented along x1(see Fig. 3) should be identical for a large number of
spheres. For the detailed models, the field variables were
extracted at identical x1 coordinates and then averaged.
At each x1 coordinate, 95% confidence intervals on the
mean value were computed. Finally, the averaged distribu-
tions of the detailed models were compared to the
distributions of the multi-scale model.
In the following subsections, distributions of the field
variables predicted from the multi-scale framework are
compared to those of the detailed FE meshes of Section4.
5.2. Temperature distribution
Fig. 4(a) and (b) show the temperature distributions ob-
tained from the homogenized model as well as from the
heterogeneous composite reinforced by 20% of Ti6Al4V
particles for model sizes of 20 and 40 particles, respec-
tively, for different times.Fig. 4(c) and (d) show the mean
responses of the various realizations, along with 95% con-
fidence intervals for models of 20 and 40 particles, respec-
tively. For the 20 particle model, the largest width of the
confidence interval is 1.74% of the mean value while it is
of 3.42% for the 40 particles model. The width of the confi-
dence interval decreases as the time increases. Fig. 5(a)(f)
show temperature profiles from similar type of analyses
but for a composite reinforced by 30% of Ti6Al4V parti-
cles and for models containing 15, 30 and 45 particles.
The largest widths of the confidence intervals are of
3.25%, 1.88% and 3.7% for the 15, 30 and 45 particle models,
respectively. It is interesting to note that the confidence
interval widths did not decrease as the number of particles
increased, as would have been expected. The reasons for
this phenomenon are unclear at this time. Conducting
more realizations and/or simulating larger number of par-
ticles might lead to the expected tendency and this phe-
nomenon might be of statistical nature.
Fig. 6(a) shows the mean temperature curves for a com-
posite with 20% of Ti6Al4V particle volume content and
for models containing 20 and 40 particles. Considering
their relatively narrow confidence intervals, it can be seen
that the RVE has been reached for these microstructures
since both the 20 and 40 particle models lead to very sim-
ilar results. Fig. 6(b) shows the mean temperature curves
for the 15, 30 and 45 particle models for composites with
30% particle volume content. It can also be concluded that
the RVE size has been reached and overcome. Figs. 4 and 5
show that the micromechanical model predicts fairly well
the temperature profiles for the range of material proper-
ties simulated.
5.3. Displacement distribution
Fig. 7(a) and (b) show the displacement distributions
obtained from the homogeneous and heterogeneous mod-
els for a composite containing 20% of Ti6Al4V particles
for models having 20 and 40 particles, respectively.
Fig. 7(c) and (d) show the average response of the various
realizations, along with 95% confidence intervals on the
mean value for models containing 20 and 40 particles,
respectively. For the 20 particles model, the largest width
of the confidence interval is 96% of the mean value while
it is of 52% for the 40 particles model.
Fig. 8(a)(f) show displacements from similar analyses
butfor a composite reinforced by 30% of Ti6Al4V particles
for models containing 15, 30 and 45 particles. The largest
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100
200
300
400
AxialStresses(
11
)MPa
t =2s
Detail Microstructural Model (Volume fraction = 20%)
40 particles
20 particles
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0
100
200
300
400
Axial
Stresses(
11
)MPa
t =12s
Detail Microstructural Model (Volume fraction = 20%)
40 particles
20 particles
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0
100
200
300
400
AxialStresses(
11
)MPa
t=26s
Detail Microstructural Model (Volume fraction = 20%)
40 particles
20 particles
0 2 4 6 8 10
Distance (mm)
0 2 4 6 8 10
Distance (mm)
0 2 4 6 8 10
Distance (mm)
a
b
c
Fig. 14. Mean stress profiles for FE models with the unit cell (microme-
chanical model) at each integration point (solid line) and the FE models
with 3D microstructural detail (symbols) for volume fraction of (a) 20% atdifferent times.
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widths of the confidence intervals were of 30%, 65% and
143% for the 15, 30 and 45 particle models, respectively.
Fig. 9(a) shows the superimposed curves for 20 and 40
particles model for a sphere volume fraction of 20%. Consid-
ering thewidth of theconfidence intervals ofFig. 7, itcan be
seen that the average responses are reasonably close and
hence that the RVE has been reached. These observations
allow to conclude that the micro-mechanical model pre-
dicts relatively well the macroscopic response of the
composite for this specific microstructure. Fig. 9(b) shows
the superimposed curves for 15, 30 and 45 particles model
for a sphere volume fraction of 30%. For times t= 12 s and
t= 26 s (seconds), the huge widths of the confidence inter-
vals (see Fig. 8(d)(f)) do not allow to conclude whether the
size of the RVE has been reached or not within a reasonable
precision and hence render these RVE analyses meaning-
less. However, fort= 2 s, the confidence intervals are rela-
tively narrow and it is possible to conclude fromFig. 9(b)
that for this time, the RVE size has been reached. For
t= 2 s, it seems that the micro-mechanical model predicts
relatively well the homogenized displacement distribution,
although it is less accurate than the microstructure having
20% of reinforcements. Moreover, it seems that performing
simulations with more than 45 reinforcements might lead
to narrower confidence intervals for a better assessment
of the RVE size. Finally, it can be observed that the micro-
mechanical model predicts with more accuracy the tem-
perature distribution than the displacement field, for the
cases studied here.
5.4. Thermal stresses distributions
The contrast in the CTEs values of the constituents and
high temperature gradient are the main cause for the gen-
eration of high thermal stresses.Figs. 1013show the var-
iation of thermal stresses for spheres volume fractions of
20% and 30% at different times for the homogenized and
heterogeneous composites, respectively. For all the figures,
except for t= 2 s over a certain distance, the width of the
confidence intervals cannot be used to determine if the
RVE size has been reached with a high degree of confi-
dence. For t= 2 s, it seems that the micro-mechanical
TOP ELEMENTS
BOTTOM ELEMENTS
-400
-200
0
200
400
AxialStresses(
11
)MPa
t =26s
a
TOP ELEMENTS
BOTTOM ELEMENTS
-400
-200
0
200
400
AxialStresses(
11
)MPa
t=26s
Detail Microstructural Model
Model-1
b
Detail Microstructural Model
Model-2
0 2 4 6 8 10
Distance (mm)0 2 4 6 8 10
Distance (mm)
Fig. 15. Axial thermal stresses for FE models with 3D microstructural detail for volume fraction of 20% att= 26 s. (a) and (b) are actual values of stresses at
top (corner) edge {(X1, 10, 10); 06X1 6 10} for model-2 and model-1, respectively.
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model can predict reasonably well the thermal stresses
distribution. However, for all the other cases, the results
suggest that the micromechanical model is not capable of
capturing the thermal stresses with good accuracy. To cor-
roborate the above-mentioned hypothesis, the mean val-
ues of axial thermal stress at different times are shown
in Fig. 14(a)(c) for the microstructures having 20% of rein-
forcements. More realizations, and possibly with models
having more reinforcements, are required for confirming
this hypothesis with more confidence.
The localized stresses are found in some models which
are generally due to the specific micro-geometrical fea-
tures and the high fluctuation about the mean stress pro-
file is due to the presence or absence of the particle
along the profile where the stresses are computed. These
high compressive stresses are found in those matrix ele-
ments which surround the particle region. In this study
the thermal expansion of the particle is higher than the
surrounding matrix at all temperatures. Therefore, during
transient heat conduction the free expansion of the particle
is constrained by the surrounding matrix elements. The
larger CTE mismatch of particle/matrix elements results
in such high values of compressive stresses in the neigh-
boring elements of particle.
For example, consider model-2 shown in Fig. 15(a) for
which the high compressive stresses are found in the ma-
trix region that restraints the free expansion of two parti-
cle regions. Similar behavior is found for the elements
neighboring the particle region approximately at 2.5 mm
and 8.3 mm, respectively. For the same temperature differ-
ence the particle expands more than the matrix but the
surrounding restraints provided by the matrix elements
are the main cause for the generation of such high values
of compressive stresses. The same description is applicable
to other models where such micro-geometrical features
are found; for example, see belowFig. 15(b) of model-1.
5.5. Effective displacement
The effective displacement, (d1), is defined asd1 e11 L,wheree11 is the volume average of the strains in x1 direc-tion and L is the length of the cube. For both the multi-scale
and the detailed models, (d1) was computed at the face of
loading (BDHF inFig. 3(c)) for composites having a sphere
volume fraction of 20% and 30%, respectively. The
d1 as afunction of time is plotted inFig. 16(a) and (b). The mean
values of effective displacements (along with 95%
confidence intervals) for heterogeneous composite models
0
0.005
0.01
0.015
0.02
Displacements(mm
)
Displacements(mm)
Detail Microstructural Model(Volume fraction = 30%, 30 particles)
Micromechanical Model
Model-1
Model-2
Model-3
Model-4
0
0.005
0.01
0.015
0.02
Steady State Time = 150 seconds
Detail Microstructural Model(Volume fraction = 20%, 20 particles)
Micromechanical Model
Model-1
Model-2
Model-3
Model-4
Model-5
Model-6
300K
600KCenter line
0
0.005
0.01
0.015
0.02
Displacements(mm)
Detail Microstructural Model(Volume fraction = 30%, 30 particles)
Micromechanical Model
0 5 10 15 20 25 30
Time (seconds)
0 5 10 15 20 25 30
Time (seconds)
0 5 10 15 20 25 30
Time (seconds)
0 5 10 15 20 25 30
Time (seconds)
0
0.005
0.01
0.015
0.02
Displa
cements(mm)
Detail Microstructural Model(Volume fraction = 20%, 20 particles)
Micromechanical Model
a c
b d
Fig. 16. Effective Axial displacements for FE models with the unit cell (micromechanical model) at each integration point (solid line) and the FE models
with 3D microstructural detail (symbols) for volume fraction of (a) 20% and (b) 30%. Mean values of effective displacements for (c) 20% and (d) 30% with C.Iof 95%.
624 K.A. Khan et al./ Mechanics of Materials 43 (2011) 608625
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having 20% and 30% reinforcement particles are shown in
Fig. 16(c) and (d). Agreement of these results corroborate
that the present micromechanical formulation is suitable
for the prediction of effective responses of composites
through the incorporation of a nonlinear thermo-elastic
constitutive material model.
6. Summary
The transient responses of the homogenized and heter-
ogeneous composites due to coupled heat conduction and
mechanical loading have been studied. For the tempera-
ture response, the RVE size was reached for both models
having 20% and 30% reinforcements. It was found that
the temperature distribution is relatively well predicted
with the multi-scale model. The width of the confidence
intervals for the displacements were larger than those for
the temperature but allowed nevertheless to conclude that
the multi-scale framework can also predict with a reason-
able accuracy the displacement field inside the composite.
The RVE size was not reached for the thermal stresses andit is not possible to conclude that the multi-scale frame-
work is suitable for representing accurately these stresses.
Larger RVEs or many more simulations for the same RVE
sizes would be required in order to narrow the confidence
intervals. However, the mean results obtained are encour-
aging and running more simulations might reveal that the
multi-scale framework is also suitable for evaluating the
thermal stresses. Finally, the multi-scale model reasonably
predicts the effective displacement. Therefore, the main
contribution of this work was the development and the
partial validation of a multi-scale framework that allows
predicting the field variables of a temperature dependent
thermo-mechanical problem.
Acknowledgements
This research is sponsored by the Air Force Office of Sci-
entific Research (AFOSR) under Grant No. FA 9550-10-1-
0002. We also thank the Texas A&M Supercomputing Facil-
ity (http://sc.tamu.edu/) for providing computing resources
useful in conducting the research reported in this paper.
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