Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 16.82773 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 3.62199 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 0.91538 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 31.68203 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 40.83867 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 -17.93093 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 5.00546 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 12.92547 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 16.82773 3.62199 0.91538 31.68203 40.83867 -17.93093 5.00546 value: 2.87947583964755 0.125000000000000 3.739350315164675E-004 f,g S 2.87947584 0.00037394 f,g F 2.87947405 0.00037394 D1, D2, P, A, A/P, sn, gs, a, d : 3.57140E-06 -1.78570E-06 1.78570E-06 1.78713E-06 1.00080E+00 4.97755E-02 -3.57140E-06 1.00080E+00 4.97755E-02 f,g G 2.87947405 0.00000050 f,g F 2.87947405 0.00000050 D1, D2, P, A, A/P, sn, gs, a, d : 1.33550E-11 -6.67749E-12 6.67749E-12 6.67244E-12 9.99244E-01 3.09474E-04 -1.33550E-11 9.99245E-01 4.98154E-02 CONVERGENCE: FRTOL TEST SATISFIED value: 2.87947405251343 nfev, nfghev: 2 2 Final value: 2.879474 After optimisation: 1 1.00000E-04 1.68375E+01 9.99900E+03 -2.74898E-07 2 0.00000E+00 3.62611E+00 9.99000E+02 -3.56787E-07 3 1.00000E-04 9.15726E-01 9.99000E+02 2.28159E-07 4 0.00000E+00 3.16954E+01 9.99000E+02 1.05756E-09 5 0.00000E+00 4.08855E+01 9.99000E+02 -4.81180E-09 6 -9.99000E+02 -1.79310E+01 9.99000E+02 -7.41752E-10 7 -9.99000E+02 5.00390E+00 9.99000E+02 -1.07274E-09 nvar, nfree, nbind: 7 7 0 Final model : 2.879474 6.48E-12 3 1 Laue 16.83753 1 0.00010 9999.00000 1 1 K_over T 16.82773 0.04163 3.62611 1 0.00000 999.00000 2 2 B_frag_imp T 3.62199 0.07657 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 0.91573 1 0.00010 999.00000 6 3 K_solv T 0.91538 0.01534 31.69538 1 0.00000 999.00000 7 4 B_solv T 31.68203 2.73162 1.0 -1 1.0 1.0 0 K_solv_imp F 40.88549 1 0.00000 999.00000 8 5 B_solv_imp T 40.83867 1.80563 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.93102 1 -999.00000 999.00000 10 6 B11_over T -17.93093 0.21676 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.00390 1 -999.00000 999.00000 12 7 B22_over T 5.00546 0.20949 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 12.92712 -1 -999.00000 999.00000 15 B33_over F 12.92547 0.00000