Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 17.14682 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 16.42770 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 0.94309 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 29.02460 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 18.61104 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 -18.59124 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 5.86187 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 12.72937 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 17.14682 16.42770 0.94309 29.02460 18.61104 -18.59124 5.86187 value: 3.21460531876882 0.125000000000000 1.091026016461161E-003 f,g S 3.21460532 0.00109103 f,g F 3.21457517 0.00109103 D1, D2, P, A, A/P, sn, gs, a, d : 6.11006E-05 -3.05503E-05 3.05503E-05 3.01473E-05 9.86808E-01 9.69709E-01 -6.11006E-05 9.86980E-01 1.25000E-01 f,g G 3.21457517 0.00002315 f,g F 3.21457515 0.00002315 D1, D2, P, A, A/P, sn, gs, a, d : 3.96663E-08 -1.98331E-08 1.98331E-08 1.98410E-08 1.00040E+00 3.37491E-02 -3.96663E-08 1.00040E+00 5.00000E-01 f,g G 3.21457515 0.00000001 f,g F 3.21457515 0.00000001 D1, D2, P, A, A/P, sn, gs, a, d : 3.36285E-14 -1.68142E-14 1.68142E-14 3.99680E-15 2.37704E-01 5.73875E-05 -3.36285E-14 5.67441E-01 5.00000E-01 CONVERGENCE: FRTOL TEST SATISFIED value: 3.21457515163193 nfev, nfghev: 3 3 Final value: 3.214575 After optimisation: 1 1.00000E-04 1.71871E+01 9.99900E+03 -2.85152E-10 2 0.00000E+00 1.62023E+01 9.99000E+02 -4.37851E-09 3 1.00000E-04 9.43085E-01 9.99000E+02 3.37927E-09 4 0.00000E+00 2.86441E+01 9.99000E+02 -9.69061E-11 5 0.00000E+00 1.94864E+01 9.99000E+02 -1.38900E-10 6 -9.99000E+02 -1.85690E+01 9.99000E+02 2.54138E-11 7 -9.99000E+02 5.84393E+00 9.99000E+02 4.72571E-12 nvar, nfree, nbind: 7 7 0 Final model : 3.214575 6.72E-15 3 1 Laue 17.18708 1 0.00010 9999.00000 1 1 K_over T 17.14682 0.06652 16.20231 1 0.00000 999.00000 2 2 B_frag_imp T 16.42770 0.30191 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 0.94308 1 0.00010 999.00000 6 3 K_solv T 0.94309 0.01795 28.64414 1 0.00000 999.00000 7 4 B_solv T 29.02460 3.66393 1.0 -1 1.0 1.0 0 K_solv_imp F 19.48637 1 0.00000 999.00000 8 5 B_solv_imp T 18.61104 2.91897 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -18.56902 1 -999.00000 999.00000 10 6 B11_over T -18.59124 0.32029 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.84393 1 -999.00000 999.00000 12 7 B22_over T 5.86187 0.31376 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 12.72509 -1 -999.00000 999.00000 15 B33_over F 12.72937 0.00000