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GrainAdv.

Rev. boundary
Mater. rotations
Sci. 37 (2014)
near crack
97-104tips in deformed nanomaterials 97

GRAIN BOUNDARY ROTATIONS NEAR CRACK TIPS IN


DEFORMED NANOMATERIALS

2 7OG
CPHK1,2,3 and A.G. Sheinerman1,2,3
1
Department of Mathematics and Mechanics, St. Petersburg State University, St. Petersburg 198504, Russia
2
Institute of Problems of Mechanical Engineering, Russian Academy of Sciences,
Bolshoj 61, Vasilievskii Ostrov, St. Petersburg 199178, Russia
3
St. Petersburg State Polytechnical University, St. Petersburg 195251, Russia
Received: June 2, 2014

Abstract. A special mechanism/mode of plastic deformation occurring through stress-driven


rotations of low-angle grain boundaries (GBs) near crack tips in nanocrystalline and ultrafine-
grained (UFG) materials is theoretically described. It is demonstrated that such rotations of GBs
represent energetically favorable processes in wide ranges of parameters characterizing pre-
cracked specimens with nanocrystalline and UFG structures. Also, these rotations of GBs in part
release high stresses concentrated near crack tips and thus hamper crack growth.

Nanoscale deformation processes occurring in load. In Letter [18], GB rotations were theoretically
nanowires, micropillars, nanocrystalline and UFG described as stress-driven processes representing
materials represents the subject of intensive re- a new deformation mechanism in solids. As it has
search efforts in materials science and physics of been demonstrated in Letter [18], stress-driven ro-
]P] b cadR c
da Tb1bTTTV N 'o'-O]]P] R ahb cP[[
X
]T tations of GBs effectively carry plastic flow and trans-
and UFG bulk solids, specific (inherent to form GB defect configurations in nanocrystalline
nanostructures) mechanisms/modes of plastic flow nanowires, nanopillars and thin films as well as
effectively operate due to the combined nanoscale within subsurface areas of bulk nanocrystalline sol-
and grain-boundary effects N ()-.' ''(' o',O ids due to the combined actions of the nanoscale,
In nanowires and micropillars having either single grain-boundary and free-surface effects. Plastic de-
crystalline or amorphous structures, the combined formation carried by rotations of GBs is accompa-
nanoscale and free-surface effects strongly influ- nied by crystal lattice rotations in the areas swept
ence plastic deformation processes and thereby by rotating GBs [18] and thereby can be treated as
strength and ductility [1,4-7,9,13]. Recently, a par- a partial case of rotational deformation (defined as
ticular attention has been devoted to nanowires and plastic deformation accompanied by crystal lattice
micropillars with nanocrystalline and UFG structures ac PcX]bN '/O 9 [ [fX ]Vc WTTgTa X T]c P[SPc
PN (o
Pbb [ XSbfWTa TcWTc WaTTTU U
TRcboc WTnanoscale, 24], crystal lattice rotations intensively occur in vi-
grain-boundary and free-surface effects oR Ta P cinities of cracks growing in nanostructured
tively operate, which can cause the actions of un- (nanocrystalline or UFG) materials. In the context
usual modes of plastic deformation [8,10,17,18]. For discussed, it is highly interesting to understand, if
instance, the experiment [8] revealed GB transfor- stress-driven GB rotations can occur and thereby
PcX]b UP ]Tf c h T o :5 ac Pc
X]b o X ] R ]c aX
Qdc Tc c WTTg Ta X T]c P[[
h QbTa eTSN ( o( O
nanocrystalline Ni nanopillars under a mechanical crystal lattice rotations in vicinities of cracks grow-
Corresponding author: Ilya Ovid'ko, email: ovidko@nano.ipme.ru

n( ' 4Se
P]RTSFc
dSh6T]c
Ta6 c
S
98 , 2L E E DE

ing in nanostructured materials. The answer to this the crack length L is much larger than the distance
question is not a trivial extension of the results pre- d, so that in our further calculations the crack can
sented in Letter [18], because there are several be approximated as a semi-infinite one.
peculiarities differentiating the behavior of defects Following [18], the rotation of the GB AB occurs
near cracks from that in subsurface areas of through the cooperative slip of edge dislocations
nanostructured solids (far from cracks). They are composing this GB in the direction normal to the
briefly as follows: (i) local stresses are typically GB plane AB over various distances in such a way
much higher near crack tips due to stress concen- that the rotating GB is flat and thus moves to its
tration, as compared to the subsurface area; (ii) ]Tf bX cX]45s (Fig. 1c). The GBs AB and AD are
stress distribution is highly inhomogeneous near unchanged during the rotation of the GB AB. In this
crack tips due to the effect of the crack, as com- situation, their combined role as a stress source is
pared to the subsurface area; (iii) free surfaces as- effectively described by a wedge disclination located
sociated with a growing crack grow and thus change at the triple junction A and characterized by strength
local stresses in vicinities of cracks, in contrast to [18]. The tilt misorientation angles of the GBs
conventional (unchanged) free surfaces of solids. AB, CA, and DA at the triple junction A in the initial
The main aim of this paper is to examine and theo- state of the system (before the GB rotation; see
retically describe the special mechanism of plastic Fig. 1b) are balanced, in which case the triple junc-
STUa Pc X]RPa aXTSQhbc aTbboSa Xe T]:5ac Pc X]b tion A does not create stresses. In other words, in
near cracks in nanostructured materials. In particu- the initial state of the defect configuration (Fig. 1b),
lar, we will reveal basic characteristics of such rota- the long-range stresses created by the edge dislo-
tions and compare them with those of the previously cations composing the GB AB are completely com-
examined [18] GB rotations in subsurface areas of pensated for by the wedge disclination at the triple
nanostructured materials. junction A, that approximates the long-range
Let us consider the geometric features of plas- stresses created by the static GBs CA and AD. In
tic deformation mode occurring through stress-driven doing so, the disclination strength w is equal by
rotations of low-angle tilt boundaries near cracks in magnitude and opposite in sign to the tilt
nanostructured solids. Fig. 1a schematically shows misorientation of the GB AB ( = -).
a two-dimensional section of a nanostructured solid During the rotation of the GB, it transforms from
consisting of nanoscale or ultrafine grains divided symmetric tilt boundary in the initial state (Fig. 1b)
by GBs and containing a flat crack. The solid is into asymmetric one in the final state after the rota-
under a tensile load 0 whose direction is normal to tion (Fig. 1c). It is related to the fact that the Burgers
the crack plane. The area of the solid near the crack vectors of GB dislocations change their orientation
contains a low-angle tilt boundary AB which is pre- relative to the GB plane during its rotation. That is,
sented in the magnified inset in Fig. 1b. The plane after the rotation of the GB, the Burgers vector of
of the GB AB makes the angle with the specimen TPR WU X
cbSX b
[RPc X]b[RPc TSPc cWT:5 [ P]T45s
free surface and has the common point B with the has non-zero components parallel and perpendicu-
free surface (Fig. 1b). Also, the solid contains static [Pac c WT:5 [ P]T45s (Fig. 1c), in contrast to the
symmetric GBs CA and DA that form the triple junc- initial GB state in which the parallel component is
tion A with the GB AB (Fig. 1b). We consider the zero (Fig. 1b).
GB AB rotation under the action of the applied load In addition, the tilt misorientation angle of the
concentrated near the crack tip B, in which case GB decreases (from to s SdTc c WT:5ac PcX]
the GB rotates around the triple junction A from the because the perpendicular component of Burgers
X]XcXP[ bX cX]45c P]Tf bX cX]45s9X V 'R vectors characterizing its dislocations after the GB
Following the theory of low-angle tilt boundaries [25], rotation (Fig. 1c) decreases, as compared to that in
the GB AB is represented as a wall of periodically the initial GB state (Fig. 1b). The decrease in the
(with a period p) arranged edge perfect dislocations tilt misorientation angle violates the balance = -
characterized by the same Burgers vector b (Fig. of the misorientation angles of the GBs at the triple
1b). We denote the GB rotation angle made by the junction A, and thereby the junction A becomes a
[X]Tb45P]S45s Pb, the length of the GB AB as stress source whose elastic energy represents the
d, and the crack length as L. We characterize the main hampering force for the GB rotation process.
stress near the crack tip by the stress intensity Also, in the course of the GB rotation, some
factor KI related to the applied load 0 and crack dislocations approach the surface of the semi-infi-
length L as KI = L / 2 . We also assume that nite crack and disappear, producing steps at the
0
Grain boundary rotations near crack tips in deformed nanomaterials 99

Fig. 1. (Color online) Geometry of grain boundary rotation near a crack in a nanocrystalline specimen. (a)
General view of nanocrystalline specimen containing a crack. Figures (b) and (c) show a magnified inset of
the region near the crack where stress-driven rotation of a tilt grain boundary occurs. (b) Initial state. A low-
P]V[ Tbh Tc a
XRc X
[cQ d]SPa h45pPfP[ [UTa XSXR P[[
hb PRTSTSVTSX b[RPcX]b pX b[R Pc TS]TPac WTU aTT
surface and forms a triple junction A with two static symmetric tilt boundaries AC and AD. (c) Stress-driven
cooperative motion of GB dislocations occurs which results in tilt boundary rotation (by angle ) from its
X]Xc
XP[ bX cX]45cP]Tf bX c
X]45s4[ b Va PX]Q d]SPa hac PcX][ TPSbcc WTSX bP TPa P]RT U bTe TaP[
grain boundary dislocations at the crack surface and associated formation of steps at this surface. (d) The
defect configuration consisting of both periodically arranged dislocations with the Burgers vectors b in the
rotated dislocation wall and the disclination characterized by the strength at the triple junction A is
presented as the defect configuration consisting of a pile-up of dislocations with the Burgers vectors b|| ,
parallel to the plane of the rotated GB and the disclination with the strength 1 = sin2at the same triple
junction (for details, see text). (e) Decomposition of the periodically arranged dislocations with the Burgers
vectors b into a pile-up of dislocations with the Burgers vectors b , parallel to the plane of the rotated GB,
and a wall of dislocations with the Burgers vectors b normal to the plane of the rotated GB. The wall
of dislocations with the Burgers vectors is approximately equivalent to a wedge disclination with the
strength s
100 , 2L E E DE

crack surface. In general, this affects the critical proper energy of the kth dislocation with the Burgers
vector b||, Wint ( rk , ) is the energy of the interac-
d
stress intensity factor for crack advance. However,
for simplicity, in the following we neglect the effect tion between the kth dislocation with the Burgers
of the steps at the crack surface on crack propaga- vector b || and the disclination of strength 1,
Wint ( rk , r j , ) is the energy of the interaction between
d d
tion and consider the crack as a flat one. Also, the
nanocrystalline specimen is conventionally modeled the kth and jth dislocations having the Burgers vec-
as an isotropic solid characterized by the shear tors b||, Ae() is the total work spent by the stress
modulus G P]SC X bb ]s ba X.
Pc field (created by the applied load in the solid con-
Let us calculate the energy change W (per unit taining the crack (Fig. 1a)) on the motion of all the
length of dislocations) specifying GB rotation near dislocations with the Burgers vectors b to either their
the crack tip (Figs. 1b and 1c). To do so, for conve- new positions or the crack surface, and Wstep is the
nience of the calculations, we present each dislo- surface energy of a step created by a dislocation
cation having the Burgers vector b as the superpo- that enters the crack surface (Figs. 1c and 1d).
sition of the two dislocations characterized by the The expression for the energy W of the
Burgers vectors b and b|| perpendicular and paral- disclination in an isotropic solid with a semi-infinite
lel to the rotating GB plane, respectively (Fig. 1e). crack has been calculated previously [26]. The en-
The Burgers vectors magnitude b and b|| are given ergy Wstep follows as (e.g., [18]) Wstep= b, where is
as: b = bcosand b|| = bsin, respectively. Also, the specific surface energy. The other terms in for-
note that the finite regular wall of the dislocations mula (1) have been calculated in the standard way
specified by the Burgers vectors b and the period [18] using the known expressions [26,27] for the
p/cosas a stress source is equivalent to a wedge stresses created by individual dislocations and
disclination located at the triple junction A and char- disclinations in a solid containing a semi-infinite
acterized by the strength s bcos/(p/cos) = crack (see Appendix A).
-(b/p)cos2(Fig. 1e). Since b/p, we find: s As a result, we have calculated the energy
cos2. The superposition of this disclination and change W in the exemplary case of nickel. In our
the initial disclination located at the triple junction A calculations, we have used the following typical val-
and characterized by the strength w represents the ues of parameters characterizing Ni [25]: G = 73
disclination having the strength 1 = + s 2 sin2 GPa, = 0.34, b = 0.25 nm, s
= 2.28 J/m2. The
(Fig. 1d). dependences of the energy change W on the angle
As it has been noted previously in this paper, in of GB rotation are presented in Fig. 2, for the fol-
the initial state of the defect configuration (Fig. 1b), lowing values of parameters: = 15m , d = 10 nm,
the stresses created by the edge dislocations com- KI = 1 MPa m1/2, and various values of the angle .
posing the GB AB are completely compensated for The chosen value of KI is approximately equal to
by the wedge disclination located at the triple junc- the critical stress intensity factor KIC for brittle frac-
tion A and characterized by the strength . In this ture. (The latter is given [28] by K IC 4G /(1 ) ,
case, the initial defect configuration (Fig. 1b) con-
which yields: KIC =1.004 MPa m1/2.)
sisting of the dislocation wall AB and the disclination Fig. 2 demonstrates that the curves W() show
at the triple junction A does not possess any elas-
local oscillations that are, apparently, associated
tic energy. Then the energy change W can be pre-
with both the uncertainties in the energies of dislo-
sented as follows: cations located very close (at the distance about
N one interatomic distance) to the crack surface as
W W ( rk , )
d
W well as computational errors. However, with these
k 1
oscillations neglected, one can see that W first
decreases and then increases with increasing .
N N N

Wint ( rk , ) Wint ( rk , r j , )
d d d

k 1 k 1 j k 1
(1) For some angle = eq the energy change W is
minimum. The equilibrium value eq of the angle
Ae ( ) (N0 N )Wstep ,
depends on the GB orientation with respect to the
where N0 is the initial number of dislocations, N is GB plane (characterized by the angle ). In particu-
the number of dislocations after GB rotation, and lar, when VafbU a ) mc , m c WTP]V[ Teq
rk = kp/cosis the distance from the kth dislocation X]Ra TPbTbU a P agX Pc T[h mc P agX Pc T[h
to the triple junction A after GB rotation. Also, in ' mGWTe P[dTeq = 10mis large enough and indi-
formula (1), W denotes the proper energy of the cates that pronounced GB rotations can occur near
disclination A with the strength 1, Wd(rk, ) is the crack tips in mechanically loaded solids.
Grain boundary rotations near crack tips in deformed nanomaterials 101

hanced, as compared to GB rotations near free sur-


faces of nanostructured materials free from cracks.
In particular, when the crack length L is large enough
(L 1 m ), cracks highly enhance GB rotations.
Note that GB rotations (Fig. 1) in part release
high stresses concentrated near crack tips and thus
hamper crack growth. Our theoretical estimates of
the equilibrium angle eq of GB rotations (see above)
allow us to conclude that GB rotations (leading to
Fig. 2. (Color online) Dependences of the energy crystal lattice rotations in nanoscale regions) near
change W (characterizing grain boundary rotation cracks can significantly contribute to the experimen-
near crack) on the rotation angle . cP[[h QbTa e TSN( o( O Ra hbc
P[ [
PccX
RTac PcX]b]TPa
cracks in nanostructured materials. In parallel with
GB rotations, other modes of the rotational defor-
We now compare the equilibrium rotation angle mation can play role in the crystal lattice rotations
eq in the case of GB rotation near a crack in in question. For instance, the crystal lattice rota-
nanocrystalline Ni (Fig. 1) and that in the examined tions near cracks can be effectively carried by the
previously [18] case of GB rotation near a free sur- stress-driven migration of GBs in its conventional
face of nanocrystalline Ni. In the second case, we qXSTP[rVT Tc ahfX cWcWT X VaPcX]SX a TRcX]QTX ]V
consider GB rotations near a flat free surface, with perpendicular to the GB plane [29]. At the same
the load 0 = 0.1D 1.76 GPa (where D = G/[2 (1 - time, geometry of the stress-driven GB migration in
)]) being applied in the direction parallel to the free real nanostructured materials (see, e.g., pioneering
surface. This load creates the shear stress = 0.05D TgTa XT]c P[ fa ZbN ) )'O STe X
PcTbU a c WTq X
STP[
r
driving the dislocations to move in the planes that geometry, and these deviations and associated
make the angle of 45mwith the free surface. In this changes in grain shapes can be described in terms
case, for the initial GB length of 10 nm, GB of GB rotations.
misorientation angle of 11m , the equilibrium GB ro-
tation angle is in the range from 6mto 8m . In the case ACKNOWLEDGEMENTS
of GB rotation near a crack, we consider the same
values of the applied load, GB misorientation and This work was supported, in part, (for IAO) by St.
GB length ( 0 = 1.76 GPa, d = 10 nm, and = 11m , Petersburg State University research grant
respectively) and various values of the crack length 6.37.671.2013 and the Russian Foundation of Ba-
(50 and 207 nm) as well as various values of the sic Research (grant 12-01-00291-a), and (for AGS)
angle between the initial GB plane and crack plane by the Russian Ministry of Education and Science
( = 45mand 60m ). The crack lengths of 50 and 207 (Grant 14.B25.31.0017).
nm correspond to the stress intensity factors
KI = 0.493 MPa m1/2 and 1 MPa m1/2, respectively. APPENDIX A
With our calculations, we found the following ENERGY ASSOCIATED WITH GRAIN
results. For = 45mand L = 50 nm, we have: eq =
BOUNDARY ROTATION NEAR A
4m -6m. For = 45mand L = 207 and nm, we obtain:
eq = 6m -8m . For = 60mand L = 207 nm, we obtain:
CRACK TIP
eq = 9m -11m . For eq = 6m-8mand L = 1 m, which In this Appendix, we calculate the terms appearing
approximately describes a large blunt crack with in expression (1) for energy variation W due to GB
the length much larger than the Griffith length of a rotation near a crack tip (see Fig. 1). The expres-
sharp crack, we have: eq=16m -18m. Thus, the equi- sion for the energy W (appearing in formula (1)) of
librium angle of GB rotation near a crack tip can be the disclination in an isotropic solid with a semi-
much larger than that in the case of GB rotation infinite crack has been calculated previously [26]. It
near a free surface if the crack length is large can be presented as W = W (d, - ), where
enough. r0
To summarize, stress-driven rotations of GBs W ( r0 , 0 )
1
( r , r0 ,
, 0 ) | ( r0 r ) dr , (A1)

near cracks represent energetically favorable pro- 2 0
0

cesses in wide ranges of parameters characteriz-


ing pre-cracked nanostructured materials. Depend- ( r , r0 ,
, 0) 4 Re sin
2

ing on the crack length, GB rotations near cracks (A2)
in pre-cracked materials can be hampered or en- Re g cos 2Im g sin 2
,
102 , 2L E E DE

g ( z z )( ) ', (A3)


D z0 z0 z0 z0
(z) 1
ln z z0 ln z z0 ,
2 (A4)
z 2 z z z0

D z0 z0 z0 z0
(z) 1
ln z z0 ln z z0 , (A5)
2 z 2 z z z0

i 0
z = rei, z0 = r0 e , i 1, and D = G/[2 (1-)].

The energy Wint ( rk , ) is calculated as [32]


d

l
Wint ( rk , )
d
b|| xy
(x , y 0) dx , (A6)
rk

where l = dsin /sin( +) is the length of the GB after its rotation and x y is the component of the disclination
stress in the Cartesian coordinate system (xs ysbW f]X ]9X V4' fWX RWX bX ]cWTU[[fX]Va T[ Pc
X]fX cWc WT
disclination stress components in the Cartesian coordinate system (x,y) associated with the crack (see
Fig. A1):

x'y '
( x , y ) (1/ 2)( yy xx
) sin[2( )] xy
cos[2( )]. (A7)

The components xx
, yy
, and xy
are expressed in terms of the functions and g as [33]

xx
Re[4 g ], yy
Re[ g ], xy
Im[ g ], (A8)

where the functions and g are given by (A4) and (A5) with z = x + iy and z0 = -de-i . In turn, the
coordinates (x,y) are related to the coordinate xs 2 P TPa
(at ys X]VX]Ua d[ P 4-Pbx = -h -(l-xsR b +),


y = -(l-xsbX] +), where h = dsin/ sin( +).
The energy Wint ( rk , r j , ) of the interaction between the kth and jth dislocations with the Burgers
d d

vectors b|| is calculated as [32]


l
Wint ( rk , r j , )
d d d
b|| xy
(x , y 0) dx , (A9)
rj

d
where x y ( x , y ) is the component of the stress of the kth dislocation in the Cartesian coordinate system
(xs
ysbW f]X ]9X V 4' fWX RWXbX
]c WTU[ [fX ]Va T[PcX]fX c
Wc WTSX bR[ X
]Pc X]bc aTbbR ]T]cbX ]c WT
Cartesian coordinate system (x,y) associated with the crack (see Fig. A1):

) sin[2( )] cos[2( )].


d d d d
xy
( x , y ) (1/ 2)( yy xx xy
(A10)
d d d
The components xx
, yy
, and xy
are expressed in terms of the complex functions d
and gd as [33]
d d d
xx
Re[4 d
g d ], yy
Re[ g d ], xy
Im[ g d ], (A11)

where the functions d


and gd are given [27] by

gd d
d
( z z) d
', (A12)

1 zk 1 zk A ( zk zk ) zk z
d
(z) A 1 1 2
2 , (A13)
z zk z z zk z 2( z zk ) z zk
Grain boundary rotations near crack tips in deformed nanomaterials 103

Fig. A1. Geometry of defects in a rotated grain boundary near a crack tip.

1 zk 1 zk A ( zk zk ) zk z
d
(z) A 1 1 2
2 , (A14)
z zk z z zk z 2( z zk ) z zk

z=x+iy, zj=xj+iyj, and A = Gb||ei( +)/[8 i(1-)]. Here the coordinates (x,y) are related to the coordinate xsPc
2 P TPa
ys X]VX ]Ua d[ P 4' PbSTbR aXQTSPQ e T
The proper energy W (rk,) of the kth dislocation with the Burgers vector b|| can be presented as
d

W ( rk , ) (1/ 2)Wint ( rk , rk b, ) Db|| / 2.


d d d 2
(A15)

Here the first term on the right hand side of formula (A15) denotes the strain energy of the dislocation while
the second term designates the energy of the dislocation core.
The total work Ae()of the stress field created by the applied load in the solid with the examined crack
(Fig. 1a) done on the motion of all the dislocations with the Burgers vectors b to their new positions or to the
crack surface follows from
N0 sk
e
Ae b xy
(x rk , y ) dy , (A16)
k 1 0

e
where x y ( x , y ) is the component of the stress field created by the applied load in the examined solid
with a crack in the Cartesian coordinate system (xs syssbW f]X ]9X V4' P]Ssk is the distance moved by
the kth dislocation in the course of GB rotation. The distance sk follows as

sk min{rk tan , (d rk ) tan }. (A17)


e
The stress component x y ( x , y ) is in the following relation with the stress components in the Cartesian
coordinate system (x,y) associated with the crack (see Fig. A1):

) sin(2 )
e e e e
x '' y ''
( x '', y '') (1/ 2)( yy xx xy
cos(2 ). (A18)
104 , 2L E E DE

Using the expressions [28] for the stress field cre- [13] O.V. Kuzmin, Y.T. Pei, C.Q. Chen and J.T.M.
ated by a tensile load in an infinite solid with a semi- De Hosson // Acta Mater. 60 (2012) 889.
infinite mode I crack, formula (A18) can be presented [14] 4 Be XSsZ P]SG: P]VS ] Rev. Adv.
as Mater. Sci. 30 (2012) 103.
[15] 4 Be XSsZ P]S4: FWTX ]Ta P] Rev.
KI Adv. Mater. Sci. 35 (2013) 48.
sin cos(2
e
(x , y ) 3 / 2), (A19)
x y
2 2 r [16] 4 Be XSsZ P]SAI FZX QP Rev. Adv.
Mater. Sci. 35 (2013) 96.
s

where r = [(d - xs2
s

+ (ys ] and = - - arctan[ys
2 1/2
s [17] N.Q. Chinh, R.Z. Valiev, X. Sauvage,
s
(d - xs
O G. Varga, K. Havancsak, M. Kawasaki and
The number N of dislocations after GB rotation T.G. Langdon // Adv. Eng. Mater. (2014),
is calculated as 7B0' ' (PST ( ') +
N'.OFI 5 Qh [
TeP]S 4 Be X
SsZ Phys. Rev.
d sin cos Lett. 109 (2012) 175501.
N .
p sin( )
(A20)
[19] @ Ld :dc ZX]P]S 4 Be XSsZ Plastic
Deformation of Nanocrystalline Materials
In formula (A20) ... denotes the integer part, in con-
(Springer, Berlin, etc., 2004).
trast to other formulae where this sign designates
[20] M. Ke, W.W. Milligan, S.A. Hackney, J.E.
square brackets.
Carsley and E.C. Aifantis // Nanostruct.
The energy Wstep follows as (e.g., [18]) Wstep =
b,
Mater. 5 '//+,./
where is the specific surface energy.
[21] Z. Shan, J.A. Knapp, D.M. Follstaedt, E.A.
Thus, we have calculated all the terms appear-
Stach, J.M.K. Wiezorek and S.X. Mao //
ing in formula (1) for the energy variation W asso-
Phys. Rev. Lett. 100 (2008) 105502.
ciation with GB rotation near a crack tip. This en-
[22] S. Cheng, Y. Zhao, Y. Wang, Y. Li, X.-L.
ergy is given by formulae (1), (A1)o(A17), (A19) and
Wang, P.K. Liaw and E.J. Lavernia // Phys.
(A20).
Rev. Lett. 104 (2010) 255501.
[23] P. Liu, S.C. Mao, L.H. Wang, X.D. Han and
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