Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 16.79882 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 3.61438 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 0.91461 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 31.49562 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 40.72942 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 -17.94737 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 5.01345 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 12.93392 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 16.79882 3.61438 0.91461 31.49562 40.72942 -17.94737 5.01345 value: 2.88054730782268 0.125000000000000 2.147947217362405E-004 f,g S 2.88054731 0.00021479 f,g F 2.88054697 0.00021479 D1, D2, P, A, A/P, sn, gs, a, d : 6.75666E-07 -3.37833E-07 3.37833E-07 3.37826E-07 9.99980E-01 5.19645E-02 -6.75666E-07 9.99980E-01 5.19645E-02 f,g G 2.88054697 0.00000014 f,g F 2.88054697 0.00000014 D1, D2, P, A, A/P, sn, gs, a, d : 2.36639E-12 -1.18319E-12 1.18319E-12 1.18439E-12 1.00101E+00 5.94690E-04 -2.36639E-12 1.00101E+00 5.19645E-02 CONVERGENCE: FRTOL TEST SATISFIED value: 2.88054696999538 nfev, nfghev: 2 2 Final value: 2.880547 After optimisation: 1 1.00000E-04 1.68019E+01 9.99900E+03 2.49598E-08 2 0.00000E+00 3.61390E+00 9.99000E+02 -6.51741E-08 3 1.00000E-04 9.14626E-01 9.99000E+02 -1.24801E-07 4 0.00000E+00 3.15473E+01 9.99000E+02 -2.96896E-09 5 0.00000E+00 4.07283E+01 9.99000E+02 -7.29748E-10 6 -9.99000E+02 -1.79390E+01 9.99000E+02 8.28965E-09 7 -9.99000E+02 5.01171E+00 9.99000E+02 3.12315E-09 nvar, nfree, nbind: 7 7 0 Final model : 2.880547 3.16E-12 3 1 Laue 16.80191 1 0.00010 9999.00000 1 1 K_over T 16.79882 0.04167 3.61390 1 0.00000 999.00000 2 2 B_frag_imp T 3.61438 0.07690 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 0.91463 1 0.00010 999.00000 6 3 K_solv T 0.91461 0.01536 31.54732 1 0.00000 999.00000 7 4 B_solv T 31.49562 2.74395 1.0 -1 1.0 1.0 0 K_solv_imp F 40.72830 1 0.00000 999.00000 8 5 B_solv_imp T 40.72942 1.80379 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.93901 1 -999.00000 999.00000 10 6 B11_over T -17.94737 0.21689 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.01171 1 -999.00000 999.00000 12 7 B22_over T 5.01345 0.20961 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 12.92730 -1 -999.00000 999.00000 15 B33_over F 12.93392 0.00000