Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 16.83646 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 3.74814 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 0.90281 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 32.04646 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 39.78854 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 -17.90638 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 5.00667 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 12.89971 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 16.83646 3.74814 0.90281 32.04646 39.78854 -17.90638 5.00667 value: 2.88708491563674 0.125000000000000 8.548635797168493E-004 f,g S 2.88708492 0.00085486 f,g F 2.88707452 0.00085486 D1, D2, P, A, A/P, sn, gs, a, d : 2.07540E-05 -1.03770E-05 1.03770E-05 1.03986E-05 1.00209E+00 5.07959E-02 -2.07540E-05 1.00209E+00 5.07959E-02 f,g G 2.88707452 0.00000341 f,g F 2.88707452 0.00000341 D1, D2, P, A, A/P, sn, gs, a, d : 4.63243E-10 -2.31622E-10 2.31622E-10 2.31623E-10 1.00000E+00 1.10621E-03 -4.63243E-10 1.00000E+00 5.09021E-02 CONVERGENCE: FRTOL TEST SATISFIED value: 2.88707451676490 nfev, nfghev: 2 2 Final value: 2.887075 After optimisation: 1 1.00000E-04 1.68599E+01 9.99900E+03 -1.75419E-06 2 0.00000E+00 3.76074E+00 9.99000E+02 -2.05789E-06 3 1.00000E-04 9.03387E-01 9.99000E+02 2.07713E-06 4 0.00000E+00 3.20903E+01 9.99000E+02 1.46495E-08 5 0.00000E+00 3.97947E+01 9.99000E+02 -2.21288E-08 6 -9.99000E+02 -1.79070E+01 9.99000E+02 -7.58837E-09 7 -9.99000E+02 5.00352E+00 9.99000E+02 -2.04495E-09 nvar, nfree, nbind: 7 7 0 Final model : 2.887075 2.56E-10 3 1 Laue 16.85991 1 0.00010 9999.00000 1 1 K_over T 16.83646 0.04237 3.76074 1 0.00000 999.00000 2 2 B_frag_imp T 3.74814 0.07910 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 0.90339 1 0.00010 999.00000 6 3 K_solv T 0.90281 0.01596 32.09033 1 0.00000 999.00000 7 4 B_solv T 32.04646 2.79532 1.0 -1 1.0 1.0 0 K_solv_imp F 39.79471 1 0.00000 999.00000 8 5 B_solv_imp T 39.78854 1.79916 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.90700 1 -999.00000 999.00000 10 6 B11_over T -17.90638 0.21886 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.00352 1 -999.00000 999.00000 12 7 B22_over T 5.00667 0.21168 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 12.90348 -1 -999.00000 999.00000 15 B33_over F 12.89971 0.00000