Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 16.81955 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 3.73942 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 0.90238 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 32.01715 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 39.78284 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 -17.90701 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 5.01152 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 12.89549 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 16.81955 3.73942 0.90238 32.01715 39.78284 -17.90701 5.01152 value: 2.88766080136508 0.125000000000000 7.432846821004923E-005 f,g S 2.88766080 0.00007433 f,g F 2.88766072 0.00007433 D1, D2, P, A, A/P, sn, gs, a, d : 1.54435E-07 -7.72177E-08 7.72177E-08 7.72302E-08 1.00016E+00 3.62318E-03 -1.54435E-07 1.00016E+00 3.62318E-03 f,g G 2.88766072 0.00000003 f,g F 2.88766072 0.00000003 D1, D2, P, A, A/P, sn, gs, a, d : 2.30974E-14 -1.15487E-14 1.15487E-14 1.02141E-14 8.84431E-01 6.26652E-06 -2.30974E-14 8.96404E-01 3.62377E-03 CONVERGENCE: FRTOL TEST SATISFIED value: 2.88766072413483 nfev, nfghev: 2 2 Final value: 2.887661 After optimisation: 1 1.00000E-04 1.68216E+01 9.99900E+03 -1.21226E-08 2 0.00000E+00 3.74039E+00 9.99000E+02 -1.47535E-08 3 1.00000E-04 9.02430E-01 9.99000E+02 1.65373E-08 4 0.00000E+00 3.20197E+01 9.99000E+02 1.27073E-10 5 0.00000E+00 3.97838E+01 9.99000E+02 -1.57364E-10 6 -9.99000E+02 -1.79069E+01 9.99000E+02 -6.91531E-11 7 -9.99000E+02 5.01075E+00 9.99000E+02 -1.18372E-10 nvar, nfree, nbind: 7 7 0 Final model : 2.887661 1.36E-14 3 1 Laue 16.82158 1 0.00010 9999.00000 1 1 K_over T 16.81955 0.04235 3.74039 1 0.00000 999.00000 2 2 B_frag_imp T 3.73942 0.07914 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 0.90243 1 0.00010 999.00000 6 3 K_solv T 0.90238 0.01600 32.01971 1 0.00000 999.00000 7 4 B_solv T 32.01715 2.80264 1.0 -1 1.0 1.0 0 K_solv_imp F 39.78382 1 0.00000 999.00000 8 5 B_solv_imp T 39.78284 1.79821 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.90695 1 -999.00000 999.00000 10 6 B11_over T -17.90701 0.21890 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.01075 1 -999.00000 999.00000 12 7 B22_over T 5.01152 0.21171 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 12.89620 -1 -999.00000 999.00000 15 B33_over F 12.89549 0.00000