Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 16.97514 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 2.49131 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 0.90651 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 28.32965 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 35.01063 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 -17.68664 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 4.88436 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 12.80228 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 16.97514 2.49131 0.90651 28.32965 35.01063 -17.68664 4.88436 value: 2.81143834007699 0.125000000000000 3.793841922116562E-004 f,g S 2.81143834 0.00037938 f,g F 2.81143706 0.00037938 D1, D2, P, A, A/P, sn, gs, a, d : 2.56352E-06 -1.28176E-06 1.28176E-06 1.27896E-06 9.97811E-01 5.68179E-02 -2.56352E-06 9.97816E-01 5.68179E-02 f,g G 2.81143706 0.00000146 f,g F 2.81143706 0.00000146 D1, D2, P, A, A/P, sn, gs, a, d : 3.38149E-11 -1.69074E-11 1.69074E-11 1.69105E-11 1.00018E+00 6.97059E-05 -3.38149E-11 1.00018E+00 5.68179E-02 CONVERGENCE: FRTOL TEST SATISFIED value: 2.81143706110441 nfev, nfghev: 2 2 Final value: 2.811437 After optimisation: 1 1.00000E-04 1.69682E+01 9.99900E+03 -4.32166E-07 2 0.00000E+00 2.48577E+00 9.99000E+02 -8.62484E-07 3 1.00000E-04 9.06343E-01 9.99000E+02 1.09802E-06 4 0.00000E+00 2.83717E+01 9.99000E+02 1.20120E-08 5 0.00000E+00 3.49736E+01 9.99000E+02 -7.40724E-09 6 -9.99000E+02 -1.76886E+01 9.99000E+02 -7.26016E-09 7 -9.99000E+02 4.88523E+00 9.99000E+02 2.31927E-09 nvar, nfree, nbind: 7 7 0 Final model : 2.811437 2.88E-11 3 1 Laue 16.96821 1 0.00010 9999.00000 1 1 K_over T 16.97514 0.03826 2.48577 1 0.00000 999.00000 2 2 B_frag_imp T 2.49131 0.05731 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 0.90634 1 0.00010 999.00000 6 3 K_solv T 0.90651 0.01374 28.37169 1 0.00000 999.00000 7 4 B_solv T 28.32965 2.28522 1.0 -1 1.0 1.0 0 K_solv_imp F 34.97356 1 0.00000 999.00000 8 5 B_solv_imp T 35.01063 1.46157 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.68861 1 -999.00000 999.00000 10 6 B11_over T -17.68664 0.20003 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 4.88523 1 -999.00000 999.00000 12 7 B22_over T 4.88436 0.19190 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 12.80338 -1 -999.00000 999.00000 15 B33_over F 12.80228 0.00000