Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 17.19497 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 13.33947 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 0.97149 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 27.58237 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 30.54348 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 -17.13035 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 4.98721 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 12.14315 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 17.19497 13.33947 0.97149 27.58237 30.54348 -17.13035 4.98721 value: 3.14818740807180 0.125000000000000 5.302978886219306E-004 f,g S 3.14818741 0.00053030 f,g F 3.14818150 0.00053030 D1, D2, P, A, A/P, sn, gs, a, d : 1.18480E-05 -5.92398E-06 5.92398E-06 5.91018E-06 9.97669E-01 1.85796E-01 -1.18480E-05 9.97675E-01 1.25000E-01 f,g G 3.14818150 0.00000237 f,g F 3.14818150 0.00000237 D1, D2, P, A, A/P, sn, gs, a, d : 3.34629E-10 -1.67315E-10 1.67315E-10 1.67327E-10 1.00008E+00 1.33388E-03 -3.34629E-10 1.00008E+00 1.85364E-01 CONVERGENCE: FRTOL TEST SATISFIED value: 3.14818149772758 nfev, nfghev: 2 2 Final value: 3.148181 After optimisation: 1 1.00000E-04 1.72167E+01 9.99900E+03 5.63157E-07 2 0.00000E+00 1.32938E+01 9.99000E+02 -6.52791E-07 3 1.00000E-04 9.71796E-01 9.99000E+02 2.21141E-06 4 0.00000E+00 2.75619E+01 9.99000E+02 2.89896E-08 5 0.00000E+00 3.07201E+01 9.99000E+02 -6.65579E-09 6 -9.99000E+02 -1.71265E+01 9.99000E+02 1.10540E-08 7 -9.99000E+02 4.97909E+00 9.99000E+02 -2.07743E-08 nvar, nfree, nbind: 7 7 0 Final model : 3.148181 1.23E-10 3 1 Laue 17.21665 1 0.00010 9999.00000 1 1 K_over T 17.19497 0.06388 13.29382 1 0.00000 999.00000 2 2 B_frag_imp T 13.33947 0.23109 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 0.97180 1 0.00010 999.00000 6 3 K_solv T 0.97149 0.01851 27.56185 1 0.00000 999.00000 7 4 B_solv T 27.58237 3.55984 1.0 -1 1.0 1.0 0 K_solv_imp F 30.72006 1 0.00000 999.00000 8 5 B_solv_imp T 30.54348 2.82642 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.12654 1 -999.00000 999.00000 10 6 B11_over T -17.13035 0.30621 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 4.97909 1 -999.00000 999.00000 12 7 B22_over T 4.98721 0.29713 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 12.14745 -1 -999.00000 999.00000 15 B33_over F 12.14315 0.00000