Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 17.20114 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 3.97392 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 0.91048 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 33.02282 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 39.42630 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 -17.92076 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 5.04632 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 12.87444 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 17.20114 3.97392 0.91048 33.02282 39.42630 -17.92076 5.04632 value: 2.88316076649902 0.125000000000000 9.648522461411761E-005 f,g S 2.88316077 0.00009649 f,g F 2.88316066 0.00009649 D1, D2, P, A, A/P, sn, gs, a, d : 2.19662E-07 -1.09831E-07 1.09831E-07 1.09826E-07 9.99954E-01 1.75555E-02 -2.19662E-07 9.99954E-01 1.75555E-02 f,g G 2.88316066 0.00000002 f,g F 2.88316066 0.00000002 D1, D2, P, A, A/P, sn, gs, a, d : 3.52219E-14 -1.76109E-14 1.76109E-14 1.33227E-14 7.56500E-01 3.03745E-05 -3.52219E-14 8.04182E-01 1.75555E-02 CONVERGENCE: FRTOL TEST SATISFIED value: 2.88316065667288 nfev, nfghev: 2 2 Final value: 2.883161 After optimisation: 1 1.00000E-04 1.72034E+01 9.99900E+03 1.95432E-09 2 0.00000E+00 3.97397E+00 9.99000E+02 -1.80037E-08 3 1.00000E-04 9.10622E-01 9.99000E+02 1.29442E-08 4 0.00000E+00 3.30165E+01 9.99000E+02 2.14483E-10 5 0.00000E+00 3.94102E+01 9.99000E+02 -6.45771E-10 6 -9.99000E+02 -1.79221E+01 9.99000E+02 -4.31993E-10 7 -9.99000E+02 5.04602E+00 9.99000E+02 -4.43897E-10 nvar, nfree, nbind: 7 7 0 Final model : 2.883161 1.38E-14 3 1 Laue 17.20345 1 0.00010 9999.00000 1 1 K_over T 17.20114 0.04256 3.97397 1 0.00000 999.00000 2 2 B_frag_imp T 3.97392 0.07938 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 0.91062 1 0.00010 999.00000 6 3 K_solv T 0.91048 0.01557 33.01646 1 0.00000 999.00000 7 4 B_solv T 33.02282 2.75277 1.0 -1 1.0 1.0 0 K_solv_imp F 39.41018 1 0.00000 999.00000 8 5 B_solv_imp T 39.42630 1.81278 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.92206 1 -999.00000 999.00000 10 6 B11_over T -17.92076 0.21887 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.04602 1 -999.00000 999.00000 12 7 B22_over T 5.04632 0.21186 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 12.87604 -1 -999.00000 999.00000 15 B33_over F 12.87444 0.00000