Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 17.64667 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 21.72648 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 1.00010 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 39.19035 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 8.14347 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 -18.07039 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 5.82613 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 12.24426 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 17.64667 21.72648 1.00010 39.19035 8.14347 -18.07039 5.82613 value: 3.25403859933310 0.125000000000000 2.413018634729654E-004 f,g S 3.25403860 0.00024130 f,g F 3.25403695 0.00024130 D1, D2, P, A, A/P, sn, gs, a, d : 3.31709E-06 -1.65854E-06 1.65854E-06 1.65296E-06 9.96631E-01 3.02899E-01 -3.31709E-06 9.96643E-01 1.25000E-01 f,g G 3.25403695 0.00000051 f,g F 3.25403695 0.00000051 D1, D2, P, A, A/P, sn, gs, a, d : 1.43576E-10 -7.17881E-11 7.17881E-11 7.17737E-11 9.99799E-01 2.28541E-03 -1.43576E-10 9.99799E-01 3.01882E-01 CONVERGENCE: FRTOL TEST SATISFIED value: 3.25403694630544 nfev, nfghev: 2 2 Final value: 3.254037 After optimisation: 1 1.00000E-04 1.76555E+01 9.99900E+03 2.17370E-07 2 0.00000E+00 2.16548E+01 9.99000E+02 -2.41882E-07 3 1.00000E-04 1.00061E+00 9.99000E+02 3.93574E-07 4 0.00000E+00 3.90342E+01 9.99000E+02 1.06525E-08 5 0.00000E+00 8.39402E+00 9.99000E+02 -4.81320E-09 6 -9.99000E+02 -1.80629E+01 9.99000E+02 8.84341E-09 7 -9.99000E+02 5.82319E+00 9.99000E+02 1.50872E-09 nvar, nfree, nbind: 7 7 0 Final model : 3.254037 1.87E-11 3 1 Laue 17.65546 1 0.00010 9999.00000 1 1 K_over T 17.64667 0.06711 21.65481 1 0.00000 999.00000 2 2 B_frag_imp T 21.72648 0.38193 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 1.00061 1 0.00010 999.00000 6 3 K_solv T 1.00010 0.01882 39.03416 1 0.00000 999.00000 7 4 B_solv T 39.19035 4.63482 1.0 -1 1.0 1.0 0 K_solv_imp F 8.39402 1 0.00000 999.00000 8 5 B_solv_imp T 8.14347 3.79864 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -18.06289 1 -999.00000 999.00000 10 6 B11_over T -18.07039 0.33766 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.82319 1 -999.00000 999.00000 12 7 B22_over T 5.82613 0.33026 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 12.23970 -1 -999.00000 999.00000 15 B33_over F 12.24426 0.00000