Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 16.44046 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 6.26579 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 0.92392 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 27.05528 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 40.24612 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 -17.57301 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 4.96552 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 12.60749 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 16.44046 6.26579 0.92392 27.05528 40.24612 -17.57301 4.96552 value: 3.01951650503123 0.125000000000000 8.688442885165099E-005 f,g S 3.01951651 0.00008688 f,g F 3.01951643 0.00008688 D1, D2, P, A, A/P, sn, gs, a, d : 1.58687E-07 -7.93433E-08 7.93433E-08 7.93498E-08 1.00008E+00 1.53659E-02 -1.58687E-07 1.00008E+00 1.53659E-02 f,g G 3.01951643 0.00000001 f,g F 3.01951643 0.00000001 D1, D2, P, A, A/P, sn, gs, a, d : 6.99100E-14 -3.49550E-14 3.49550E-14 2.70894E-14 7.74980E-01 1.00035E-04 -6.99100E-14 8.16313E-01 1.53671E-02 CONVERGENCE: FRTOL TEST SATISFIED value: 3.01951642568143 nfev, nfghev: 2 2 Final value: 3.019516 After optimisation: 1 1.00000E-04 1.64385E+01 9.99900E+03 6.03054E-09 2 0.00000E+00 6.26664E+00 9.99000E+02 -1.02419E-08 3 1.00000E-04 9.23891E-01 9.99000E+02 -8.79502E-09 4 0.00000E+00 2.70406E+01 9.99000E+02 -2.77799E-10 5 0.00000E+00 4.02472E+01 9.99000E+02 -1.48917E-10 6 -9.99000E+02 -1.75752E+01 9.99000E+02 4.40437E-10 7 -9.99000E+02 4.96829E+00 9.99000E+02 -8.52083E-10 nvar, nfree, nbind: 7 7 0 Final model : 3.019516 5.92E-14 3 1 Laue 16.43852 1 0.00010 9999.00000 1 1 K_over T 16.44046 0.05132 6.26664 1 0.00000 999.00000 2 2 B_frag_imp T 6.26579 0.12902 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 0.92389 1 0.00010 999.00000 6 3 K_solv T 0.92392 0.01676 27.04061 1 0.00000 999.00000 7 4 B_solv T 27.05528 2.94436 1.0 -1 1.0 1.0 0 K_solv_imp F 40.24718 1 0.00000 999.00000 8 5 B_solv_imp T 40.24612 2.11805 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.57524 1 -999.00000 999.00000 10 6 B11_over T -17.57301 0.25784 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 4.96829 1 -999.00000 999.00000 12 7 B22_over T 4.96552 0.25019 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 12.60696 -1 -999.00000 999.00000 15 B33_over F 12.60749 0.00000