Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 17.48920 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 19.59607 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 0.95797 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 33.48205 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 13.08325 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 -18.70312 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 6.02049 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 12.68263 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 17.48920 19.59607 0.95797 33.48205 13.08325 -18.70312 6.02049 value: 3.25213441328038 0.125000000000000 8.019943625802308E-004 f,g S 3.25213441 0.00080199 f,g F 3.25213066 0.00080199 D1, D2, P, A, A/P, sn, gs, a, d : 7.53617E-06 -3.76808E-06 3.76808E-06 3.75357E-06 9.96148E-01 1.20988E-01 -7.53617E-06 9.96163E-01 1.20988E-01 f,g G 3.25213066 0.00000132 f,g F 3.25213066 0.00000132 D1, D2, P, A, A/P, sn, gs, a, d : 6.30723E-10 -3.15362E-10 3.15362E-10 3.15384E-10 1.00007E+00 4.71971E-03 -6.30723E-10 1.00007E+00 1.20988E-01 CONVERGENCE: FRTOL TEST SATISFIED value: 3.25213065939691 nfev, nfghev: 2 2 Final value: 3.252131 After optimisation: 1 1.00000E-04 1.74964E+01 9.99900E+03 4.06645E-07 2 0.00000E+00 1.95126E+01 9.99000E+02 -5.36448E-07 3 1.00000E-04 9.60621E-01 9.99000E+02 -1.13762E-06 4 0.00000E+00 3.35150E+01 9.99000E+02 -1.82222E-09 5 0.00000E+00 1.31595E+01 9.99000E+02 -2.31239E-08 6 -9.99000E+02 -1.86995E+01 9.99000E+02 5.86317E-09 7 -9.99000E+02 6.01031E+00 9.99000E+02 -1.13356E-08 nvar, nfree, nbind: 7 7 0 Final model : 3.252131 2.63E-10 3 1 Laue 17.49640 1 0.00010 9999.00000 1 1 K_over T 17.48920 0.06760 19.51263 1 0.00000 999.00000 2 2 B_frag_imp T 19.59607 0.36940 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 0.96062 1 0.00010 999.00000 6 3 K_solv T 0.95797 0.01835 33.51504 1 0.00000 999.00000 7 4 B_solv T 33.48205 4.10024 1.0 -1 1.0 1.0 0 K_solv_imp F 13.15954 1 0.00000 999.00000 8 5 B_solv_imp T 13.08325 3.37102 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -18.69949 1 -999.00000 999.00000 10 6 B11_over T -18.70312 0.33286 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 6.01031 1 -999.00000 999.00000 12 7 B22_over T 6.02049 0.32649 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 12.68919 -1 -999.00000 999.00000 15 B33_over F 12.68263 0.00000