Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 16.62990 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 2.55997 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 0.87847 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 33.61140 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 25.43967 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 -17.95647 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 5.00636 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 12.95011 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 16.62990 2.55997 0.87847 33.61140 25.43967 -17.95647 5.00636 value: 2.76811310870435 0.125000000000000 1.269611676851088E-005 f,g S 2.76811311 0.00001270 f,g F 2.76811311 0.00001270 D1, D2, P, A, A/P, sn, gs, a, d : 4.42832E-09 -2.21416E-09 2.21416E-09 2.21431E-09 1.00007E+00 4.00712E-03 -4.42832E-09 1.00007E+00 4.00712E-03 CONVERGENCE: FRTOL TEST SATISFIED value: 2.76811310649005 nfev, nfghev: 1 1 Final value: 2.768113 After optimisation: 1 1.00000E-04 1.66301E+01 9.99900E+03 -9.60620E-06 2 0.00000E+00 2.56028E+00 9.99000E+02 -6.08120E-06 3 1.00000E-04 8.78491E-01 9.99000E+02 5.63427E-06 4 0.00000E+00 3.36116E+01 9.99000E+02 9.39234E-08 5 0.00000E+00 2.54357E+01 9.99000E+02 1.82551E-07 6 -9.99000E+02 -1.79564E+01 9.99000E+02 -8.51356E-08 7 -9.99000E+02 5.00614E+00 9.99000E+02 3.70111E-07 nvar, nfree, nbind: 7 7 0 Final model : 2.768113 1.90E-09 3 1 Laue 16.63009 1 0.00010 9999.00000 1 1 K_over T 16.62990 0.03434 2.56028 1 0.00000 999.00000 2 2 B_frag_imp T 2.55997 0.05118 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 0.87849 1 0.00010 999.00000 6 3 K_solv T 0.87847 0.01200 33.61158 1 0.00000 999.00000 7 4 B_solv T 33.61140 2.00129 1.0 -1 1.0 1.0 0 K_solv_imp F 25.43569 1 0.00000 999.00000 8 5 B_solv_imp T 25.43967 1.13512 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.95635 1 -999.00000 999.00000 10 6 B11_over T -17.95647 0.19154 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.00614 1 -999.00000 999.00000 12 7 B22_over T 5.00636 0.18392 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 12.95021 -1 -999.00000 999.00000 15 B33_over F 12.95011 0.00000