Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 16.63009 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 2.56028 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 0.87849 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 33.61158 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 25.43569 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 -17.95635 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 5.00614 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 12.95021 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 16.63009 2.56028 0.87849 33.61158 25.43569 -17.95635 5.00614 value: 2.76812319753905 0.125000000000000 1.260872279812653E-005 f,g S 2.76812320 0.00001261 f,g F 2.76812320 0.00001261 D1, D2, P, A, A/P, sn, gs, a, d : 4.05951E-09 -2.02975E-09 2.02975E-09 2.02985E-09 1.00005E+00 3.65832E-03 -4.05951E-09 1.00005E+00 3.65832E-03 CONVERGENCE: FRTOL TEST SATISFIED value: 2.76812319550919 nfev, nfghev: 1 1 Final value: 2.768123 After optimisation: 1 1.00000E-04 1.66303E+01 9.99900E+03 -9.94646E-06 2 0.00000E+00 2.56056E+00 9.99000E+02 -5.26007E-06 3 1.00000E-04 8.78506E-01 9.99000E+02 5.67609E-06 4 0.00000E+00 3.36117E+01 9.99000E+02 8.10484E-08 5 0.00000E+00 2.54321E+01 9.99000E+02 1.80747E-07 6 -9.99000E+02 -1.79562E+01 9.99000E+02 -1.45567E-07 7 -9.99000E+02 5.00593E+00 9.99000E+02 3.18072E-07 nvar, nfree, nbind: 7 7 0 Final model : 2.768123 1.55E-09 3 1 Laue 16.63028 1 0.00010 9999.00000 1 1 K_over T 16.63009 0.03434 2.56056 1 0.00000 999.00000 2 2 B_frag_imp T 2.56028 0.05118 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 0.87851 1 0.00010 999.00000 6 3 K_solv T 0.87849 0.01200 33.61168 1 0.00000 999.00000 7 4 B_solv T 33.61158 2.00114 1.0 -1 1.0 1.0 0 K_solv_imp F 25.43206 1 0.00000 999.00000 8 5 B_solv_imp T 25.43569 1.13500 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.95621 1 -999.00000 999.00000 10 6 B11_over T -17.95635 0.19154 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.00593 1 -999.00000 999.00000 12 7 B22_over T 5.00614 0.18393 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 12.95028 -1 -999.00000 999.00000 15 B33_over F 12.95021 0.00000