Details of MaxLik refinement
Calling alabaster 1 8 9 Calling optimiser: i var_all var_fixed constraint 1 17.20838 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 2 4.10778 0.00000 0.0 1.0 0.0 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 0.0 4 0.00000 0.00000 0.0 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 0.0 6 0.92017 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 0.0 7 30.76784 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 0.0 8 45.78802 0.00000 0.0 0.0 0.0 0.0 1.0 0.0 0.0 0.0 9 0.00000 0.00000 0.0 0.0 0.0 0.0 0.0 1.0 0.0 0.0 10 -17.89396 0.00000 0.0 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 0.0 12 5.06818 0.00000 0.0 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 0.0 14 0.00000 0.00000 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 15 12.82577 0.00000 0.0 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 17.20838 4.10778 0.92017 30.76784 45.78802 0.00000 -17.89396 5.06818 value: 2.89982773452579 0.125000000000000 7.632053507237360E-003 f,g S 2.89982773 0.00763205 f,g F 2.89831346 0.00763205 D1, D2, P, A, A/P, sn, gs, a, d : 3.24821E-03 -1.62411E-03 1.62411E-03 1.51428E-03 9.32374E-01 3.34915E+00 -3.24821E-03 9.36658E-01 1.25000E-01 f,g G 2.89831346 0.00162081 f,g F 2.89828749 0.00162081 D1, D2, P, A, A/P, sn, gs, a, d : 5.16751E-05 -2.58376E-05 2.58376E-05 2.59702E-05 1.00513E+00 1.12445E+00 -5.16751E-05 1.00516E+00 5.00000E-01 f,g G 2.89828749 0.00001610 f,g F 2.89828745 0.00001610 D1, D2, P, A, A/P, sn, gs, a, d : 6.85968E-08 -3.42984E-08 3.42984E-08 3.42868E-08 9.99663E-01 9.35299E-02 -6.85968E-08 9.99663E-01 1.13025E+00 f,g G 2.89828745 0.00000007 f,g F 2.89828745 0.00000007 D1, D2, P, A, A/P, sn, gs, a, d : 1.67175E-13 -8.35873E-14 8.35873E-14 8.57092E-14 1.02539E+00 7.56518E-05 -1.67175E-13 1.02605E+00 1.13025E+00 CONVERGENCE: FRTOL TEST SATISFIED value: 2.89828745372493 nfev, nfghev: 4 4 Final value: 2.898287 After optimisation: 1 1.00000E-04 1.67549E+01 9.99900E+03 -4.76878E-08 2 0.00000E+00 3.76359E+00 9.99000E+02 2.65033E-08 3 1.00000E-04 9.11498E-01 9.99000E+02 -4.69760E-08 4 0.00000E+00 2.85205E+01 9.99000E+02 -1.12537E-09 5 0.00000E+00 4.38198E+01 9.99000E+02 -6.74517E-10 6 -9.99000E+02 -1.59986E+00 9.99000E+02 2.00653E-08 7 -9.99000E+02 -1.79481E+01 9.99000E+02 -6.60276E-10 8 -9.99000E+02 5.10199E+00 9.99000E+02 4.58810E-11 nvar, nfree, nbind: 8 8 0 Final model : 2.898287 8.48E-14 3 1 Laue 16.75493 1 0.00010 9999.00000 1 1 K_over T 17.20838 0.11213 3.76359 1 0.00000 999.00000 2 2 B_frag_imp T 4.10778 0.08415 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 0.92017 0.01595 28.52052 1 0.00000 999.00000 7 4 B_solv T 30.76784 2.83026 1.0 -1 1.0 1.0 0 K_solv_imp F 43.81979 1 0.00000 999.00000 8 5 B_solv_imp T 45.78802 2.11913 -1.59986 1 -999.00000 999.00000 9 6 B_over T 0.00000 0.29236 -17.94805 1 -999.00000 999.00000 10 7 B11_over T -17.89396 0.22128 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.10199 1 -999.00000 999.00000 12 8 B22_over T 5.06818 0.21376 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 12.84606 -1 -999.00000 999.00000 15 B33_over F 12.82577 0.00000