Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 17.57544 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 22.34563 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 0.99384 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 40.68894 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 5.85306 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 -18.14427 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 5.85702 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 12.28725 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 17.57544 22.34563 0.99384 40.68894 5.85306 -18.14427 5.85702 value: 3.26026084987880 0.125000000000000 5.354707251176038E-004 f,g S 3.26026085 0.00053547 f,g F 3.26025771 0.00053547 D1, D2, P, A, A/P, sn, gs, a, d : 6.30758E-06 -3.15379E-06 3.15379E-06 3.13988E-06 9.95590E-01 4.27383E-01 -6.30758E-06 9.95609E-01 1.25000E-01 f,g G 3.26025771 0.00000160 f,g F 3.26025771 0.00000160 D1, D2, P, A, A/P, sn, gs, a, d : 6.33251E-10 -3.16625E-10 3.16625E-10 3.16656E-10 1.00010E+00 5.25369E-03 -6.33251E-10 1.00010E+00 4.25507E-01 CONVERGENCE: FRTOL TEST SATISFIED value: 3.26025770968158 nfev, nfghev: 2 2 Final value: 3.260258 After optimisation: 1 1.00000E-04 1.75846E+01 9.99900E+03 4.86740E-07 2 0.00000E+00 2.22416E+01 9.99000E+02 -4.80710E-07 3 1.00000E-04 9.95508E-01 9.99000E+02 -1.44632E-06 4 0.00000E+00 4.04519E+01 9.99000E+02 1.44359E-08 5 0.00000E+00 6.19694E+00 9.99000E+02 -2.20882E-08 6 -9.99000E+02 -1.81332E+01 9.99000E+02 1.53334E-08 7 -9.99000E+02 5.85240E+00 9.99000E+02 2.58620E-09 nvar, nfree, nbind: 7 7 0 Final model : 3.260258 3.17E-10 3 1 Laue 17.58462 1 0.00010 9999.00000 1 1 K_over T 17.57544 0.06671 22.24163 1 0.00000 999.00000 2 2 B_frag_imp T 22.34563 0.39676 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 0.99551 1 0.00010 999.00000 6 3 K_solv T 0.99384 0.01855 40.45191 1 0.00000 999.00000 7 4 B_solv T 40.68894 4.60875 1.0 -1 1.0 1.0 0 K_solv_imp F 6.19694 1 0.00000 999.00000 8 5 B_solv_imp T 5.85306 3.77686 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -18.13320 1 -999.00000 999.00000 10 6 B11_over T -18.14427 0.33943 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.85240 1 -999.00000 999.00000 12 7 B22_over T 5.85702 0.33215 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 12.28080 -1 -999.00000 999.00000 15 B33_over F 12.28725 0.00000