Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 16.67034 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 2.74343 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 0.87768 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 35.58818 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 24.07425 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 -17.90879 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 4.92413 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 12.98467 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 16.67034 2.74343 0.87768 35.58818 24.07425 -17.90879 4.92413 value: 2.78089787032930 0.125000000000000 1.195811926303377E-004 f,g S 2.78089787 0.00011958 f,g F 2.78089782 0.00011958 D1, D2, P, A, A/P, sn, gs, a, d : 1.06576E-07 -5.32881E-08 5.32881E-08 5.32612E-08 9.99495E-01 2.28469E-02 -1.06576E-07 9.99496E-01 2.28469E-02 f,g G 2.78089782 0.00000006 f,g F 2.78089782 0.00000006 D1, D2, P, A, A/P, sn, gs, a, d : 1.06025E-13 -5.30124E-14 5.30124E-14 4.70735E-14 8.87971E-01 2.26684E-05 -1.06025E-13 8.99257E-01 2.28469E-02 CONVERGENCE: FRTOL TEST SATISFIED value: 2.78089781706804 nfev, nfghev: 2 2 Final value: 2.780898 After optimisation: 1 1.00000E-04 1.66706E+01 9.99900E+03 1.24977E-08 2 0.00000E+00 2.74182E+00 9.99000E+02 -5.29171E-08 3 1.00000E-04 8.77655E-01 9.99000E+02 2.29410E-08 4 0.00000E+00 3.56005E+01 9.99000E+02 3.75133E-10 5 0.00000E+00 2.40933E+01 9.99000E+02 -7.15148E-10 6 -9.99000E+02 -1.79083E+01 9.99000E+02 -7.24059E-11 7 -9.99000E+02 4.92263E+00 9.99000E+02 -1.08981E-09 nvar, nfree, nbind: 7 7 0 Final model : 2.780898 9.33E-14 3 1 Laue 16.67062 1 0.00010 9999.00000 1 1 K_over T 16.67034 0.03475 2.74182 1 0.00000 999.00000 2 2 B_frag_imp T 2.74343 0.05159 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 0.87766 1 0.00010 999.00000 6 3 K_solv T 0.87768 0.01250 35.60054 1 0.00000 999.00000 7 4 B_solv T 35.58818 2.03040 1.0 -1 1.0 1.0 0 K_solv_imp F 24.09333 1 0.00000 999.00000 8 5 B_solv_imp T 24.07425 1.11554 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.90832 1 -999.00000 999.00000 10 6 B11_over T -17.90879 0.19508 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 4.92263 1 -999.00000 999.00000 12 7 B22_over T 4.92413 0.18746 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 12.98569 -1 -999.00000 999.00000 15 B33_over F 12.98467 0.00000