Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 17.01166 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 5.41629 0.00000 0.0 1.0 0.0 0.0 0.0 0.0 0.0 3 1.00000 1.00000 0.0 0.0 0.0 0.0 0.0 0.0 0.0 4 0.00000 0.00000 0.0 0.0 0.0 0.0 0.0 0.0 0.0 5 0.00000 0.00000 0.0 0.0 0.0 0.0 0.0 0.0 0.0 6 0.93335 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 29.64968 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 42.00094 0.00000 0.0 0.0 0.0 0.0 1.0 0.0 0.0 9 0.00000 0.00000 0.0 0.0 0.0 0.0 0.0 0.0 0.0 10 -17.37316 0.00000 0.0 0.0 0.0 0.0 0.0 1.0 0.0 11 0.00000 0.00000 0.0 0.0 0.0 0.0 0.0 0.0 0.0 12 4.91841 0.00000 0.0 0.0 0.0 0.0 0.0 0.0 1.0 13 0.00000 0.00000 0.0 0.0 0.0 0.0 0.0 0.0 0.0 14 0.00000 0.00000 0.0 0.0 0.0 0.0 0.0 0.0 0.0 15 12.45475 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 17.01166 5.41629 0.93335 29.64968 42.00094 -17.37316 4.91841 value: 2.96251090891072 0.125000000000000 1.701968705238354E-004 f,g S 2.96251091 0.00017020 f,g F 2.96251050 0.00017020 D1, D2, P, A, A/P, sn, gs, a, d : 8.25058E-07 -4.12529E-07 4.12529E-07 4.12611E-07 1.00020E+00 2.79618E-02 -8.25058E-07 1.00020E+00 2.79618E-02 f,g G 2.96251050 0.00000005 f,g F 2.96251050 0.00000005 D1, D2, P, A, A/P, sn, gs, a, d : 6.37996E-13 -3.18998E-13 3.18998E-13 3.35287E-13 1.05106E+00 2.29739E-04 -6.37996E-13 1.05381E+00 2.79674E-02 CONVERGENCE: FRTOL TEST SATISFIED value: 2.96251049629933 nfev, nfghev: 2 2 Final value: 2.962510 After optimisation: 1 1.00000E-04 1.70168E+01 9.99900E+03 -2.96743E-08 2 0.00000E+00 5.41778E+00 9.99000E+02 -4.49717E-08 3 1.00000E-04 9.33416E-01 9.99000E+02 -1.14779E-09 4 0.00000E+00 2.96735E+01 9.99000E+02 -8.28387E-10 5 0.00000E+00 4.20148E+01 9.99000E+02 -6.43606E-10 6 -9.99000E+02 -1.73735E+01 9.99000E+02 1.57395E-10 7 -9.99000E+02 4.91810E+00 9.99000E+02 -4.26425E-10 nvar, nfree, nbind: 7 7 0 Final model : 2.962510 3.54E-13 3 1 Laue 17.01678 1 0.00010 9999.00000 1 1 K_over T 17.01166 0.04796 5.41778 1 0.00000 999.00000 2 2 B_frag_imp T 5.41629 0.10700 1.00000 -1 0.00010 999.00000 3 K_rand F 1.00000 0.00000 0.00000 -1 -999.00000 999.00000 4 B_rand F 0.00000 0.00000 1.0 -1 1.0 1.0 0 K_rand_imp F 0.00000 -1 0.00000 999.00000 5 B_rand_imp F 0.00000 0.00000 0.93342 1 0.00010 999.00000 6 3 K_solv T 0.93335 0.01618 29.67353 1 0.00000 999.00000 7 4 B_solv T 29.64968 2.88876 1.0 -1 1.0 1.0 0 K_solv_imp F 42.01482 1 0.00000 999.00000 8 5 B_solv_imp T 42.00094 2.06052 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.37349 1 -999.00000 999.00000 10 6 B11_over T -17.37316 0.24202 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 4.91810 1 -999.00000 999.00000 12 7 B22_over T 4.91841 0.23412 0.00000 -1 -999.00000 999.00000 13 B13_over F 0.00000 0.00000 0.00000 -1 -999.00000 999.00000 14 B23_over F 0.00000 0.00000 12.45540 -1 -999.00000 999.00000 15 B33_over F 12.45475 0.00000