Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 16.65205 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 14.80417 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 0.96854 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 27.33032 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 26.29187 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 -17.52747 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 5.33124 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 12.19624 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 16.65205 14.80417 0.96854 27.33032 26.29187 -17.52747 5.33124 value: 3.19041098035127 0.125000000000000 3.255557249226139E-004 f,g S 3.19041098 0.00032556 f,g F 3.19040838 0.00032556 D1, D2, P, A, A/P, sn, gs, a, d : 5.20917E-06 -2.60458E-06 2.60458E-06 2.59889E-06 9.97814E-01 9.17128E-02 -5.20917E-06 9.97819E-01 9.17128E-02 f,g G 3.19040838 0.00000108 f,g F 3.19040838 0.00000108 D1, D2, P, A, A/P, sn, gs, a, d : 1.08149E-10 -5.40743E-11 5.40743E-11 5.40799E-11 1.00010E+00 7.47721E-04 -1.08149E-10 1.00010E+00 9.17128E-02 CONVERGENCE: FRTOL TEST SATISFIED value: 3.19040838140675 nfev, nfghev: 2 2 Final value: 3.190408 After optimisation: 1 1.00000E-04 1.66644E+01 9.99900E+03 3.23967E-07 2 0.00000E+00 1.47645E+01 9.99000E+02 -3.26255E-07 3 1.00000E-04 9.68706E-01 9.99000E+02 9.77972E-07 4 0.00000E+00 2.73242E+01 9.99000E+02 1.26973E-08 5 0.00000E+00 2.63705E+01 9.99000E+02 -5.36273E-09 6 -9.99000E+02 -1.75119E+01 9.99000E+02 2.27509E-08 7 -9.99000E+02 5.32159E+00 9.99000E+02 -3.89435E-09 nvar, nfree, nbind: 7 7 0 Final model : 3.190408 5.06E-11 3 1 Laue 16.66441 1 0.00010 9999.00000 1 1 K_over T 16.65205 0.06565 14.76454 1 0.00000 999.00000 2 2 B_frag_imp T 14.80417 0.27226 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 0.96871 1 0.00010 999.00000 6 3 K_solv T 0.96854 0.01825 27.32419 1 0.00000 999.00000 7 4 B_solv T 27.33032 3.80766 1.0 -1 1.0 1.0 0 K_solv_imp F 26.37051 1 0.00000 999.00000 8 5 B_solv_imp T 26.29187 2.95903 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.51193 1 -999.00000 999.00000 10 6 B11_over T -17.52747 0.31794 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.32159 1 -999.00000 999.00000 12 7 B22_over T 5.33124 0.30955 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 12.19035 -1 -999.00000 999.00000 15 B33_over F 12.19624 0.00000