Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 16.94653 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 4.67073 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 0.92618 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 31.27280 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 42.44830 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 -17.61494 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 4.98702 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 12.62792 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 16.94653 4.67073 0.92618 31.27280 42.44830 -17.61494 4.98702 value: 2.93181394731905 0.125000000000000 4.456656393761167E-004 f,g S 2.93181395 0.00044567 f,g F 2.93181090 0.00044567 D1, D2, P, A, A/P, sn, gs, a, d : 6.08131E-06 -3.04065E-06 3.04065E-06 3.04401E-06 1.00110E+00 6.72914E-02 -6.08131E-06 1.00111E+00 6.72914E-02 f,g G 2.93181090 0.00000066 f,g F 2.93181090 0.00000066 D1, D2, P, A, A/P, sn, gs, a, d : 4.31362E-11 -2.15681E-11 2.15681E-11 2.15712E-11 1.00014E+00 1.17360E-03 -4.31362E-11 1.00014E+00 6.73658E-02 CONVERGENCE: FRTOL TEST SATISFIED value: 2.93181090328331 nfev, nfghev: 2 2 Final value: 2.931811 After optimisation: 1 1.00000E-04 1.69599E+01 9.99900E+03 -4.55513E-07 2 0.00000E+00 4.67863E+00 9.99000E+02 -4.65018E-07 3 1.00000E-04 9.26455E-01 9.99000E+02 1.27112E-07 4 0.00000E+00 3.13292E+01 9.99000E+02 -3.36452E-09 5 0.00000E+00 4.24830E+01 9.99000E+02 -6.09065E-09 6 -9.99000E+02 -1.76146E+01 9.99000E+02 -1.22260E-09 7 -9.99000E+02 4.98469E+00 9.99000E+02 -2.04509E-09 nvar, nfree, nbind: 7 7 0 Final model : 2.931811 1.17E-11 3 1 Laue 16.95988 1 0.00010 9999.00000 1 1 K_over T 16.94653 0.04534 4.67863 1 0.00000 999.00000 2 2 B_frag_imp T 4.67073 0.09382 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 0.92646 1 0.00010 999.00000 6 3 K_solv T 0.92618 0.01606 31.32923 1 0.00000 999.00000 7 4 B_solv T 31.27280 2.89377 1.0 -1 1.0 1.0 0 K_solv_imp F 42.48302 1 0.00000 999.00000 8 5 B_solv_imp T 42.44830 1.99592 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.61459 1 -999.00000 999.00000 10 6 B11_over T -17.61494 0.23219 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 4.98469 1 -999.00000 999.00000 12 7 B22_over T 4.98702 0.22478 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 12.62990 -1 -999.00000 999.00000 15 B33_over F 12.62792 0.00000