Details of MaxLik refinement

Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 16.75493 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 3.76359 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 0.91150 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 30.12037 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 43.81979 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 -17.94805 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 5.10199 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 12.84606 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 16.75493 3.76359 0.91150 30.12037 43.81979 -17.94805 5.10199 value: 2.89828907470117 0.125000000000000 1.789740279832214E-006 f,g S 2.89828907 0.00000179 f,g F 2.89828907 0.00000179 D1, D2, P, A, A/P, sn, gs, a, d : 1.17931E-10 -5.89657E-11 5.89657E-11 5.89613E-11 9.99926E-01 1.55485E-03 -1.17931E-10 9.99926E-01 1.55485E-03 CONVERGENCE: FRTOL TEST SATISFIED value: 2.89828907464221 nfev, nfghev: 1 1 Final value: 2.898289 After optimisation: 1 1.00000E-04 1.67549E+01 9.99900E+03 1.73652E-06 2 0.00000E+00 3.76355E+00 9.99000E+02 1.07049E-07 3 1.00000E-04 9.11504E-01 9.99000E+02 4.09611E-07 4 0.00000E+00 3.01188E+01 9.99000E+02 2.45375E-08 5 0.00000E+00 4.38198E+01 9.99000E+02 5.08099E-09 6 -9.99000E+02 -1.79481E+01 9.99000E+02 4.04490E-08 7 -9.99000E+02 5.10206E+00 9.99000E+02 -7.85407E-08 nvar, nfree, nbind: 7 7 0 Final model : 2.898289 5.29E-11 3 1 Laue 16.75489 1 0.00010 9999.00000 1 1 K_over T 16.75493 0.04339 3.76355 1 0.00000 999.00000 2 2 B_frag_imp T 3.76359 0.08399 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 0.91150 1 0.00010 999.00000 6 3 K_solv T 0.91150 0.01586 30.11882 1 0.00000 999.00000 7 4 B_solv T 30.12037 2.82920 1.0 -1 1.0 1.0 0 K_solv_imp F 43.81982 1 0.00000 999.00000 8 5 B_solv_imp T 43.81979 1.92905 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.94811 1 -999.00000 999.00000 10 6 B11_over T -17.94805 0.22057 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.10206 1 -999.00000 999.00000 12 7 B22_over T 5.10199 0.21350 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 12.84605 -1 -999.00000 999.00000 15 B33_over F 12.84606 0.00000