Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 17.13073 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 4.58432 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 0.92776 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 31.32163 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 43.45579 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 -17.65804 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 4.98181 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 12.67622 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 17.13073 4.58432 0.92776 31.32163 43.45579 -17.65804 4.98181 value: 2.92106631064200 0.125000000000000 1.633892844564898E-004 f,g S 2.92106631 0.00016339 f,g F 2.92106603 0.00016339 D1, D2, P, A, A/P, sn, gs, a, d : 5.71264E-07 -2.85632E-07 2.85632E-07 2.85508E-07 9.99566E-01 2.52880E-02 -5.71264E-07 9.99566E-01 2.52880E-02 f,g G 2.92106603 0.00000017 f,g F 2.92106603 0.00000017 D1, D2, P, A, A/P, sn, gs, a, d : 5.69894E-13 -2.84947E-13 2.84947E-13 2.84217E-13 9.97438E-01 4.43358E-05 -5.69894E-13 9.97445E-01 2.52880E-02 CONVERGENCE: FRTOL TEST SATISFIED value: 2.92106602513372 nfev, nfghev: 2 2 Final value: 2.921066 After optimisation: 1 1.00000E-04 1.71344E+01 9.99900E+03 4.25551E-08 2 0.00000E+00 4.58134E+00 9.99000E+02 -7.35499E-08 3 1.00000E-04 9.27820E-01 9.99000E+02 1.52201E-07 4 0.00000E+00 3.13175E+01 9.99000E+02 2.30930E-09 5 0.00000E+00 4.34800E+01 9.99000E+02 -3.93867E-10 6 -9.99000E+02 -1.76610E+01 9.99000E+02 -7.09602E-10 7 -9.99000E+02 4.98434E+00 9.99000E+02 1.08369E-09 nvar, nfree, nbind: 7 7 0 Final model : 2.921066 3.07E-13 3 1 Laue 17.13443 1 0.00010 9999.00000 1 1 K_over T 17.13073 0.04520 4.58134 1 0.00000 999.00000 2 2 B_frag_imp T 4.58432 0.09221 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 0.92782 1 0.00010 999.00000 6 3 K_solv T 0.92776 0.01615 31.31753 1 0.00000 999.00000 7 4 B_solv T 31.32163 2.88946 1.0 -1 1.0 1.0 0 K_solv_imp F 43.47996 1 0.00000 999.00000 8 5 B_solv_imp T 43.45579 2.01292 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.66103 1 -999.00000 999.00000 10 6 B11_over T -17.65804 0.22875 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 4.98434 1 -999.00000 999.00000 12 7 B22_over T 4.98181 0.22141 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 12.67669 -1 -999.00000 999.00000 15 B33_over F 12.67622 0.00000