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Table 3-3:   Calculation of critical nucleation parameters and nucleation rate at zero internal and externally applied
                             stress. Case of accommodation energy model of solvus hysteresis - equilibrium solvus assumed to be
                             given by TSSD solvus [Pan et al., 1996].

                   Critical nucleus dimensions

                                                Note: Axis of rotation of ellipsoid is
                                                about x1:
                   Values of some   Tn(K) = 558.1   VZr(m /(mol Zr)) =   e11 = 0.172   rH(H/Zr) = 1.48   Nnud(sites/m ) = 4.30
                                                    3
                                                                                                   3
                   parameters                   1.401 10                                  10
                                                        5
                                                                                              22
                                  = 0.3121     (MPa) = 3.031   e22 = 0     β  = 1.5      Heter.nucl.red.factor
                                                                              δ
                                                                                                   -6
                                                10                                        = 1.00 10
                                                   4
                                 E(MPa) = 7.95   kB(J/(K atom)) =   e33 = 0   cH (rH/β ) =
                                                                              δ
                                                                                  δ
                                 10            1.380 10                    0.98667
                                    4
                                                        -23
                                                                              O
                                 c(J/m ) = 0.0062  Ao(g/mol) = 6.025   Z = 0.1   cH (at. fn) =
                                      2
                                                   23
                                                10                          0.008969331
                                                                  O
                                      2
                                 p(J/m ) =     R(J/(K∙mol)) =   cH (wppm) =   d(m) = 4.50
                                                                                -10
                                 c+2i= 0.0186   8.3144       100          10
                   TSS equations-  H(TSSD; J/mol   A(wppm) = 3.92
                   Pan et al;    H) = 31000     10
                                                   4
                   constant A:
                                 H(TSSP1;
                                 J/mol H) = 27704
                                 H(TSSP2;
                                 J/mol H) = 28942
                   Solvus        TD(K) = 624.5   TD(C) = 351.5   DH(m s ) =
                                                                    2 -1
                   temperatures                                 1.14 10
                                                                       -10
                   (at given
                   CH (wppm)):   TP1(K) = 558.1   TP1(C) = 285.1   d(m) = 4.50
                     o
                                                                10
                                                                   -10
                                 TP2(K) = 583.1   TP2(C) = 310.1
                   Estimated     Teq(K) = 624.5   H(Teq;J/mol H) =
                   equilibrium                  29953
                   solvus values:
                                 Teq(C) = 351.5   cH s, eq (wppm) =
                                                49.2
                   Chemical      g , nucl (chem., J/m ) = -2.321 10
                                                          8
                                               3
                   energy:
                   Strain energy reduction factor: 1
                   Critical nucleus dimensions when  depends only on the ratio of surface energies:





















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