Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 17.89839 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 11.77056 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 0.98164 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 26.29310 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 38.34605 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 -17.28102 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 4.84498 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 12.43604 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 17.89839 11.77056 0.98164 26.29310 38.34605 -17.28102 4.84498 value: 3.10281468939177 0.125000000000000 3.799254379997547E-004 f,g S 3.10281469 0.00037993 f,g F 3.10281168 0.00037993 D1, D2, P, A, A/P, sn, gs, a, d : 6.05093E-06 -3.02546E-06 3.02546E-06 3.01178E-06 9.95476E-01 2.68812E-01 -6.05093E-06 9.95496E-01 1.25000E-01 f,g G 3.10281168 0.00000273 f,g F 3.10281168 0.00000273 D1, D2, P, A, A/P, sn, gs, a, d : 3.95286E-10 -1.97643E-10 1.97643E-10 1.97650E-10 1.00004E+00 3.36873E-03 -3.95286E-10 1.00004E+00 2.67602E-01 CONVERGENCE: FRTOL TEST SATISFIED value: 3.10281167741843 nfev, nfghev: 2 2 Final value: 3.102812 After optimisation: 1 1.00000E-04 1.79090E+01 9.99900E+03 3.80606E-07 2 0.00000E+00 1.17165E+01 9.99000E+02 -7.75330E-07 3 1.00000E-04 9.81765E-01 9.99000E+02 2.58978E-06 4 0.00000E+00 2.61831E+01 9.99000E+02 4.22874E-08 5 0.00000E+00 3.85867E+01 9.99000E+02 -4.17678E-09 6 -9.99000E+02 -1.72862E+01 9.99000E+02 -1.31395E-08 7 -9.99000E+02 4.84252E+00 9.99000E+02 -9.83409E-09 nvar, nfree, nbind: 7 7 0 Final model : 3.102812 5.37E-11 3 1 Laue 17.90900 1 0.00010 9999.00000 1 1 K_over T 17.89839 0.06322 11.71647 1 0.00000 999.00000 2 2 B_frag_imp T 11.77056 0.19960 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 0.98177 1 0.00010 999.00000 6 3 K_solv T 0.98164 0.01960 26.18313 1 0.00000 999.00000 7 4 B_solv T 26.29310 3.44529 1.0 -1 1.0 1.0 0 K_solv_imp F 38.58665 1 0.00000 999.00000 8 5 B_solv_imp T 38.34605 2.79634 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.28622 1 -999.00000 999.00000 10 6 B11_over T -17.28102 0.29043 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 4.84252 1 -999.00000 999.00000 12 7 B22_over T 4.84498 0.28187 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 12.44370 -1 -999.00000 999.00000 15 B33_over F 12.43604 0.00000