Details of MaxLik refinement

Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 16.57001 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 6.30381 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 0.92675 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 27.79018 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 40.25900 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 -17.50864 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 4.94078 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 12.56786 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 16.57001 6.30381 0.92675 27.79018 40.25900 -17.50864 4.94078 value: 3.01338868186776 0.125000000000000 1.150975664402746E-005 f,g S 3.01338868 0.00001151 f,g F 3.01338868 0.00001151 D1, D2, P, A, A/P, sn, gs, a, d : 5.15449E-09 -2.57725E-09 2.57725E-09 2.57731E-09 1.00003E+00 4.33283E-03 -5.15449E-09 1.00003E+00 4.33283E-03 CONVERGENCE: FRTOL TEST SATISFIED value: 3.01338867929044 nfev, nfghev: 1 1 Final value: 3.013389 After optimisation: 1 1.00000E-04 1.65705E+01 9.99900E+03 -1.12166E-05 2 0.00000E+00 6.30388E+00 9.99000E+02 5.16209E-08 3 1.00000E-04 9.26738E-01 9.99000E+02 2.51845E-06 4 0.00000E+00 2.77890E+01 9.99000E+02 -8.06649E-08 5 0.00000E+00 4.02631E+01 9.99000E+02 2.05064E-08 6 -9.99000E+02 -1.75090E+01 9.99000E+02 -1.58319E-07 7 -9.99000E+02 4.94150E+00 9.99000E+02 -5.34725E-07 nvar, nfree, nbind: 7 7 0 Final model : 3.013389 1.62E-09 3 1 Laue 16.57046 1 0.00010 9999.00000 1 1 K_over T 16.57001 0.05092 6.30388 1 0.00000 999.00000 2 2 B_frag_imp T 6.30381 0.12683 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 0.92674 1 0.00010 999.00000 6 3 K_solv T 0.92675 0.01672 27.78901 1 0.00000 999.00000 7 4 B_solv T 27.79018 2.93662 1.0 -1 1.0 1.0 0 K_solv_imp F 40.26307 1 0.00000 999.00000 8 5 B_solv_imp T 40.25900 2.11818 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.50898 1 -999.00000 999.00000 10 6 B11_over T -17.50864 0.25663 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 4.94150 1 -999.00000 999.00000 12 7 B22_over T 4.94078 0.24885 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 12.56749 -1 -999.00000 999.00000 15 B33_over F 12.56786 0.00000