Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 17.60480 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 12.53237 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 0.97741 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 27.19534 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 34.33947 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 -17.17052 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 4.90779 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 12.26273 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 17.60480 12.53237 0.97741 27.19534 34.33947 -17.17052 4.90779 value: 3.12302400688875 0.125000000000000 1.454895184081880E-004 f,g S 3.12302401 0.00014549 f,g F 3.12302348 0.00014549 D1, D2, P, A, A/P, sn, gs, a, d : 1.05698E-06 -5.28490E-07 5.28490E-07 5.27525E-07 9.98173E-01 7.73257E-02 -1.05698E-06 9.98176E-01 7.73257E-02 f,g G 3.12302348 0.00000042 f,g F 3.12302348 0.00000042 D1, D2, P, A, A/P, sn, gs, a, d : 1.01552E-11 -5.07761E-12 5.07761E-12 5.08837E-12 1.00212E+00 2.87240E-04 -1.01552E-11 1.00213E+00 7.73257E-02 CONVERGENCE: FRTOL TEST SATISFIED value: 3.12302347935887 nfev, nfghev: 2 2 Final value: 3.123023 After optimisation: 1 1.00000E-04 1.76092E+01 9.99900E+03 7.44022E-08 2 0.00000E+00 1.25100E+01 9.99000E+02 -1.21656E-07 3 1.00000E-04 9.77364E-01 9.99000E+02 3.98729E-07 4 0.00000E+00 2.71776E+01 9.99000E+02 5.51516E-09 5 0.00000E+00 3.44110E+01 9.99000E+02 -8.60944E-10 6 -9.99000E+02 -1.71751E+01 9.99000E+02 -3.90208E-09 7 -9.99000E+02 4.90746E+00 9.99000E+02 -2.21903E-09 nvar, nfree, nbind: 7 7 0 Final model : 3.123023 3.14E-12 3 1 Laue 17.60918 1 0.00010 9999.00000 1 1 K_over T 17.60480 0.06343 12.51000 1 0.00000 999.00000 2 2 B_frag_imp T 12.53237 0.21304 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 0.97736 1 0.00010 999.00000 6 3 K_solv T 0.97741 0.01903 27.17759 1 0.00000 999.00000 7 4 B_solv T 27.19534 3.49086 1.0 -1 1.0 1.0 0 K_solv_imp F 34.41099 1 0.00000 999.00000 8 5 B_solv_imp T 34.33947 2.80354 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.17507 1 -999.00000 999.00000 10 6 B11_over T -17.17052 0.29804 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 4.90746 1 -999.00000 999.00000 12 7 B22_over T 4.90779 0.28913 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 12.26761 -1 -999.00000 999.00000 15 B33_over F 12.26273 0.00000