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Why does a crystal rotate ?
            Dierk Raabe




        Düsseldorf, Germany
         WWW.MPIE.DE
         d.raabe@mpie.de




           SFB Class 2012
Overview




           Roters et al. Acta Materi.58 (2010)   1
2
Some dislocation kinematics and kinetics: phenomena




                                                      true strain
                                                      stress




                                                                    3
Plastic deformation of a single crystal by dislocation slip




                                                              4
Plastic deformation of a single crystal by dislocation slip




                                                              5
Plastic deformation of a single crystal by dislocation slip




                                                              6
Plastic deformation of a single crystal by dislocation slip




                                                     d    dx b 1
                                                     n          m bv
                                                     dt    X Z dt




                                                                             7
Plastic deformation of a single crystal by dislocation slip




                                                  Schmid factor
                                                  S h id f t
                                         (orientation factor for that slip system)




                                                                                     8
Plastic deformation of a single crystal by dislocation slip
Plastic deformation of a single crystal by dislocation slip
Boundary condition: determines lab frame constraints




                                                       11
Single crystal plasticity: crystal shear and crystal rotation




                                                                12
Plastic deformation of a single crystal by dislocation slip




                                                     d    dx b 1
                                                     n          m bv
                                                     dt    X Z dt




                                                                             13
Kinematics, displacement

  u u(x,y,z)
  u=u(x y z)
                              (x(1),y,z)         (x(2),y,z)

                          1                  2




                               u(1)(x,y,z)        u(2)(x,y,z)
u(1)(x y z)=u(2)(x y z)
    (x,y,z)=u (x,y,z)
                          1                  2




                                      1                   2



                                                                14
Kinematics, displacement

  u u(x,y,z)
  u=u(x y z)
                              (x(1),y,z)             (x(2),y,z)

                          1                      2




                               u(1)(x,y,z)            u(2)(x,y,z)
u(1)(x y z)≠u(2)(x y z)
    (x,y,z)≠u (x,y,z)
                          1                      2




                                             1                    2


                                                                      15
Kinematics, displacement, displacement gradient: general




                                                           16
Kinematics: Micro-to-macro-transition




                                        17
Geometrical interpretation




                             ?




                                 18
Geometrical interpretation




                             19
Complex boundary conditions




                                                 mesoscopic boundary conditions
                               one dislocation   (grain / orientation neighborhood)



              parallel loops

 reactions




                                                  orientation change
                                                                                 20
Simplify boundary conditions




                Boundary conditions:

                1) Upper bound treatment: iso-stress

                2) Lower bound treatment: iso-strain
                                          iso strain




                                                       21
Iso-stress: single slip system

         a ma sym
                      b mbsym  d md sym
                                             c mcsym
                                                   1           c  b   d   a
           krit        krit     krit        krit


                                     D

           33                T
                              T
                                                 D
                   a                                 D

                           b
                                  c                          D


                                        krit
                                         aktiv


                                                 d
                                                            11

                                                                                         22
Single crystal plasticity: multiple slip (or twinning) system




                                              /mit
                                                                /mit




                                                                        23
Single crystal yield surface

                                                      33
 1 crystal, 1 slip system:

 aik nk a jlbl  ijj   crit
          j
                                    slip system 1

                                                            ..
                                    crit
                                     s 1 ( active)
               same strain


 33
   different                                                                         11
   stresses
                                                                                     slip system 2

                                                                  crit
                                                                   s  2 ( active)




                         crit
                          active
                                                                    1 crystal, 2 slip systems:

                                                                      aik nks a jlbls ij   crit
                                             11
Iso-stress: multiple slip (or twinning) system

                                     33          Ds=1
                                                                      Ds=2

      Vers
                                            ..
                    krit (+)
                      s1 ( aktiv)
                     krit,(+)
                                            TBH
                 S
                                                                               11
                   krit,(-)
                     s2
                                                          krit,(+)
                                                           s2 ( aktiv)
                 .




                                             krit,(-)
                                               s1 ( aktiv)


                                                                              Vers
    Ds=2
Single crystal plasticity

                          bcc, fcc,
                          bcc fcc                          Bcc: 24 systems
                        Section in
                       stress space
krit




                                         krit
                                          
             krit                               krit



                       BCC, 48 systems
krit




              krit

                                                                             26
Simplify boundary conditions




                Boundary conditions:

                1) Upper bound treatment: iso-stress

                2) Lower bound treatment: iso-strain
                                          iso strain




                                                       27
The Taylor Model




                   28
Crystal yield surface, Taylor Bishop-Hill




                                            29
Crystal yield surface, Taylor Bishop-Hill

Many crystals, many slip systems:
     crystals
                             grain 1
           33
                                            grain 2


                                                      g
                                                      grain 3




                                                                grain 4




                                                      imposed strain




                                                                    11
Homogeneity and boundary conditions – meso-scale

           3%                                  8%




            15%
Simplify boundary conditions




         Boundary conditions:

         1) Upper bound treatment: iso-stress (strain not compatible)

         2) Lower bound treatment: iso-strain (forces not in equilibrium)




                                                                            32
Multiscale crystal plasticity FEM or FFT




                                           Raabe, Zhao, Park, Roters: Acta Mater. 50 (2002) 421   33
Crystal Mechanics FEM, grain scale mechanics (2D)

                                                                                      Experiment
                                                                                     (DIC, EBSD)
                                                                                     v Mises strain




                                                                                       Simulation
                                                                                        (CP-FEM)
                                                                                        (C       )
                                                                                      v Mises strain




                                  Sachtleber,
                                  Sachtleber, Zhao, Raabe: Mater. Sc. Engin. A 336 (2002) 81
                                                           Mater.     Engin.                       34

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