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CZM PPT 2011
CZM PPT 2011
CZM PPT 2011
tot i
i
i i ij
j
i ij
j
E E
E F r
f r
|
where
and
Contribution to electron density
of i
th
atom and j
th
atom.
Two body central potential
between i
th
atom and j
th
atom.
( )
i
F
( )
ij
f r
ij
|
i
E
Internal energy associated with atom i
Embedded Energy of atom i.
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GRAINSTRUCTUREANDCOMPUTATIONALCRYSTAL
CONSTRUCTIONOFCOMPUTATIONALCRYSTAL
CONSTRUCTION OF COMPUTATIONAL CRYSTAL
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Boundary Conditions for GB Sliding
Construct symmetric tilt boundaries (STDB) by rotating a
single crystal (reflection)
Periodic boundary condition in X direction
Restrain few layers in lower crystal
Apply body force on top crystal
A small portion of CSL grain bounary before
And after application of tangential force
9(221) E
Curve in Shear direction
T o
Shet C, Li H, Chandra N ;Interface models for GB sliding and migration
MATER SCI FORUM 357-3: 577-585 2001
AMML
A small portion of CSL grain boundary before
And after application of normal force
9(221) E
Curve in Normal direction
T o
Summary
complete debonding occurs when the
distance of separation reaches a value of 2
to 3 .
For 9 bicrystal tangential work of
separation along the grain boundary is of
the order 3 and normal work of
separation is of the order 2.6 .
For 3 -bicrystal, the work of separation
ranges from 1.5 to 3.7 .
Rose et al. (1983) have reported that the
adhesive energy (work of separation) for
aluminum is of the order 0.5 and the
separation distance 2 to 3
Measured energy to fracture copper
bicrystal with random grain boundary is
of the order 54 and for 11 copper
bicrystal the energy to fracture is more
than 8000
A
2
J / m
2
J / m
2
J / m
A
2
J / m
2
J / m
2
J / m
Results and discussion on atomistic simulation
Implications
The numerical value of the cohesive
energy is very low when compared
to the observed experimental results
Atomistic simulation gives only
surface energy ignoring the inelastic
energies due to plasticity and other
micro processes.
It should also be noted that the exper-
imental value of fracture energy
includes the plastic work in addition
to work of separation
(J.R Rice and J. S Wang, 1989)
p
2 W | = I+
Material Nomenclature particle size
Aluminium
alloys
2024-T351 35 14900 1.2
2024-T851 25.4 8000 1.2
Titanium
alloys
T21 80 48970 2-4
T68 130 130000 2-4
Steel Medium
Carbon
54 12636 2-4
High strength
alloys
98 41617
18 Ni (300)
maraging
76 25030
Alumina 4-8 34-240 10
SiC ceramics 6.1 0.11 to 1.28
Polymers PMMA 1.2-1.7 220
1/ 2
IC
K MPam
2
IC
G J / m
2
J / m I
2 3
Al O
m
m
Table of surface and fracture energies of standard materials
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Energy balance and effect of plasticity in the
bounding material
Motivation
It is perceived that CZM represents
the physical separation process.
As seen from atomistics, fracture
process comprises mostly of inelastic
dissipative energies.
There are many inelastic dissipative
process specific to each material
system; some occur within FPZ, and
some in the bounding material.
How the energy flow takes place
under the external loading within the
cohesive zone and neighboring
bounding material near the crack tip?
What is the spatial distribution of
plastic energy?
Is there a link between micromechanics
processes of the material and curve.
T o
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Plasticity vs. other Dissipation Mechanisms
Since bounding material has its own
inelastic constitutive equation, what
is the proportion of energy dissipation
within that domain and fracture region
given by CZM.
Role of plasticity in the bounding
material is clearly unique; and cannot
be assigned to CZM.
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Al 2024-T3 alloy
The input energy in the cohesive model
are related to the interfacial stress and
characteristic displacement as
The input energy is equated to
material parameter
Based on the measured fracture value
n
o
n max n
e | = o o
t max t
e
2
| = t o
n
|
IC
J
m X
MPa
m J
t n
ult
t n
6
max
2
10 5 . 4
642
/ 8000
= =
= =
= =
o o
o o
| |
Cohesive zone parameters of a ductile material
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E=72 GPa, v=0.33,
1/ 2
IC
K 25MPa m =
Stress strain curve is given by
1/ n
y
y
E
320MPa,
0.01347,
n 0.217173
| |
o o
c = + o
|
o
\ .
o =
o =
=
where
and fracture parameter
Material model for the bounding material
Elasto-plastic model for Al 2024-T3
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Geometry and boundary/loading conditions
a = 0.025m, b = 0.1m, h = 0.1m
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Finite element mesh
28189 nodes, 24340 plane strain 4 node elements,
7300 cohesive elements (width of element along the crack plan is ~ m
7
7x10
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Global energy distribution
are confined to bounding material
w e p c
E E E E = + +
e p
E and E
c
E
is cohesive energy, a sum total of all dissipative
process confined to FPZ and cannot be recovered
during elastic unloading and reloading.
Purely elastic analysis
The conventional fracture mechanics uses the concept
of strain energy release rate
Using CZM, this fracture energy
is dissipated and no plastic
dissipation occurs, such that
U
G J
a
c
= =
c
2
G J 8000J / m | = = =
w e c
E E E = +
Global energy distribution (continued)
Issues
Fracture energy obtained from experi-
mental results is sum total of all
dissipative processes in the material for
initiating and propagating fracture.
Should this energy be dissipated
entirely in cohesive zone?
Should be split into two
identifiable dissipation processes?
Two dissipative process
2
8000J / m | =
Plasticity within
Bounding material
Micro-separation
Process in FPZ
Analysis with elasto-plastic material model
where represents other factors arising from
the shape of the traction-displacement relations
Implications
Leaves no energy for plastic work in the
bounding material
In what ratio it should be divided?
Division is non-trivial since plastic
dissipation depends on geometry, loading
and other parameters as
max
p p i
y
E E , n,S , i 1, 2,..
| |
o
= =
|
o
\ .
i
S
What are the key CZM parameters that govern the energetics?
in cohesive zone dictates the stress level achievable in the bounding
material.
Yield in the bounding material depends on its yield strength and its post
yield (hardening characteristics.
Thus plays a crucial role in determining plasticity in the bounding
material, shape of the fracture process zone and energy distribution.
(other parameters like shape may also be important)
max
o
max y
o o
y
o
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Global energy distribution (continued)
u /
E
n
e
r
g
y
/
(
1
.
0
E
-
2
)
0 20 40 60 80
0
0.5
1
1.5
2
2.5
3
3.5
4
1
2
3
4
Cumulative Plastic Work
Cumulative Cohesive Energy
2
.
o
.
o
.
y
n
8
o
n
Variation of cohesive energy and plastic energy for
various ratios
(1) (2)
(3) (4)
max y
o o
max y
1 o o =
max y
1.5 o o =
max y
2.0 o o =
max y
2.5 o o =
Recoverable elastic work 95 to
98% of external work
Plastic dissipation depends on
Elastic behavior
plasticity occurs.
Plasticity increases with
e
E =
max y
o o
max y
1 to 1.5: o o s
max y
o o
max y
1.5: o o >
Relation between plastic work and cohesive work
Plastic Energy/( 1.0E-2)
C
o
h
e
s
i
v
e
E
n
e
r
g
y
/
(
1
.
0
E
-
2
)
0 1 2 3 4
0
0.5
1
1.5
2
2.5
3
o
max
o
max
o
max
o
y
= 1.5
o
o
y
y
= 2.0
= 2.5
2.o .o .
y n
2
.
o
.
o
.
y
n
(very small scale plasticity),
plastic energy ~ 15% of total dissipation.
Plasticity induced at the initial stages
of the crack growth
plasticity ceases during crack
propagation.
Very small error is induced by ignoring
plasticity.
plastic work increases
considerably, ~100 to 200% as that of
cohesive energy.
For large scale plasticity problems the
amount of total dissipation (plastic and
cohesive) is much higher than 8000
Plastic dissipation very sensitive to
ratio beyond 2 till 3
Crack cannot propagate beyond
and completely elastic below
max y
1.5 o o =
max y
2.0 o o >
2
J / m .
max y
1.5 o o s
max y
o o
max y
3 o o >
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Variation of Normal Traction along the interface
x(m)
T
/
0 0.003 0.006 0.009 0.012 0.015 0.018
0
0.2
0.4
0.6
0.8
1
1.2
1
2
3
4
l
2
l
2
l
2
l
2
Curve l o o
max
y 2
1
2
3
4
2.5
2.0
1.5
1.0
1100
( m)
2900
4800
11000
n
(
2
.
o
)
y
The length of cohesive zone is also
affected by ratio.
There is a direct correlation
between the shape of the traction-
displacement curve and the normal
traction distribution along the
cohesive zone.
For lower ratios the
traction-separation curve flattens, this
tend to increase the overall cohesive
zone length.
max y
o o
max y
o o
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Local/spatial Energy Distribution
A set of patch of elements (each having app. 50
elements) were selected in the bounding material.
The patches are approximately squares (130 ).
They are spaced equally from each other.
Adjoining these patches, patches of cohesive
elements are considered to record the cohesive
energies.
m
Variation of Cohesive Energy
a/b
C
o
h
e
s
i
v
e
E
n
e
r
g
y
/
(
1
.
0
E
-
7
)
0.24 0.25 0.26 0.27 0.28 0.29 0.3 0.31 0.32
0
200
400
600
800
C C
C C
C
C C C
C
C
1 2 3 4 5 6
7 8
9
10
2
.
o
.
o
.
y
n
The variation of Cohesive Energy in the Wake and Forward
region as the crack propagates. The numbers indicate the
Cohesive Element Patch numbers Falling Just Below the
binding element patches
The cohesive energy in the patch increases
up to point C (corresponding to in
Figure ) after which the crack tip is
presumed to advance.
The energy consumed by the cohesive
elements at this stage is approximately 1/7
of the total cohesive energy for the present
CZM.
Once the point C is crossed, the patch of
elements fall into the wake region.
The rate of cohesive zone energy
absorption depends on the slope of the
curve and the rate at which elastic
unloading and plastic dissipation takes
place in the adjoining material.
The curves flattens out once the entire
cohesive energy is dissipated within a given
zone.
max
o
T o
max
o
max
o
n
T
sep
o
Variation of Elastic Energy
a/b
E
l
a
s
t
i
c
E
n
e
r
g
y
/
(
1
.
0
E
-
8
)
0.24 0.25 0.26 0.27 0.28 0.29 0.3 0.31 0.32 0.33
0
10
20
30
40
50
60
70
80
90
100
2
.
o
.
o
.
y
n
1
2
3
4
5
6 7 8
9
10
Variation of Elastic Energy in Various Patch of
Elements as a Function of Crack Extension. The
numbers indicate Patch numbers starting from Initial
Crack Tip
Considerable elastic energy is built up till
the peak of curve is reached after
which the crack tip advances.
After passing C, the cohesive elements near
the crack tip are separated and the elements
in this patch becomes a part of the wake.
At this stage, the values of normal traction
reduces following the downward slope of
curve following which the stress in the
patch reduces accompanied by reduction in
elastic strain energy.
The reduction in elastic strain energy is
used up in dissipating cohesive energy to
those cohesive elements adjoining this patch.
The initial crack tip is inherently sharp
leading to high levels of stress fields due to
which higher energy for patch 1
Crack tip blunts for advancing crack tip
leading to a lower levels of stress, resulting in
reduced energy level in other patches.
T o
T o
max
o
max
o
n
T
sep
o
Variation of dissipated plastic energy in various
patched as a function of crack extension. The number
indicate patch numbers starting from initial crack tip.
Variation of Plastic Work ( )
max y
2.0 o o >
max
o
max
o
n
T
sep
o
y
o
T o
c e
E and E
plastic energy accumulates considerably
along with elastic energy, when the local
stresses bounding material exceeds the yield
After reaching peak point C on curve
traction reduces and plastic deformation
ceases. Accumulated plastic work is
dissipative in nature, it remains constant after
debonding.
All the energy transfer in the wake region
occurs from elastic strain energy to the
cohesive zone
The accumulated plastic work decreases up
to patch 4 from that of 1 as a consequence of
reduction of the initial sharpness of the crack.
Mechanical work is increased to propagate
the crack, during which the does
not increase resulting in increased plastic
work. That increase in plastic work causes the
increase in the stored work in patches 4 and
beyond
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Variation of Plastic Work ( )
max y
1.5 o o s
a/b
E
n
e
r
g
y
/
(
1
.
0
E
-
8
)
0.24 0.25 0.26 0.27 0.28 0.29 0.3 0.31 0.32
0
25
50
75
100
125
2
.
o
.
o
.
y
n
Plastic Work
Elastic Energy
1
2
3
4
5
6
7
8
9
Variation of Plastic work and Elastic work in various patch
of elements along the interface for the case of .
The numbers indicates the energy in various patch of
elements starting from the crack tip.
max y
1.5 o o s
, there is no plastic dissipation.
plastic work is induced only
in the first patch of element
No plastic dissipation during crack
growth place in the forward region
Initial sharp crack tip profile induces
high levels of stress and hence plasticity
in bounding material.
During crack propagation, tip blunts
resulting reduced level of stresses
leading to reduced elastic energies and
no plasticity condition.
max y
1 o o =
max y
1.5 o o =
max
o
max
o
n
T
sep
o
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Contour plot of yield locus around the cohesive
crack tip at the various stages of crack growth.
Schematic of crack
initiation and
propagation
process in a ductile
material
Conclusion
CZM provides an effective methodology to study and simulate fracture in solids.
Cohesive Zone Theory and Model allow us to investigate in a much more
fundamental manner the processes that take place as the crack propagates in a
number of inelastic systems. Fracture or damage mechanics cannot be used in
these cases.
Form and parameters of CZM are clearly linked to the micromechanics.
Our study aims to provide the modelers some guideline in choosing appropriate
CZM for their specific material system.
ratio affects length of fracture process zone length. For smaller
ratio the length of fracture process zone is longer when compared with that of
higher ratio.
Amount of fracture energy dissipated in the wake region, depend on shape of
the model. For example, in the present model approximately 6/7th of total
dissipation takes place in the wake
Plastic work depends on the shape of the crack tip in addition to ratio.
max y
o o
max y
o o
max y
o o
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Conclusion(contd.)
IC
J
The CZM allows the energy to flow in to the fracture process zone, where a
part of it is spent in the forward region and rest in the wake region.
The part of cohesive energy spent as extrinsic dissipation in the forward region
is used up in advancing the crack tip.
The part of energy spent as intrinsic dissipation in the wake region is required
to complete the gradual separation process.
In case of elastic material the entire fracture energy given by the of the
material, and is dissipated in the fracture process zone by the cohesive
elements, as cohesive energy.
In case of small scale yielding material, a small amount of plastic dissipation
(of the order 15%) is incurred, mostly at the crack initiation stage.
During the crack growth stage, because of reduced stress field, plastic
dissipation is negligible in the forward region.