Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 17.53862 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 23.26646 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 0.97671 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 41.19829 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 4.05352 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 -18.22321 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 5.92289 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 12.30033 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 17.53862 23.26646 0.97671 41.19829 4.05352 -18.22321 5.92289 value: 3.26981131391384 0.125000000000000 2.472752888449067E-004 f,g S 3.26981131 0.00024728 f,g F 3.26981104 0.00024728 D1, D2, P, A, A/P, sn, gs, a, d : 5.39989E-07 -2.69995E-07 2.69995E-07 2.69794E-07 9.99257E-01 8.73771E-02 -5.39989E-07 9.99257E-01 8.73771E-02 f,g G 3.26981104 0.00000018 f,g F 3.26981104 0.00000018 D1, D2, P, A, A/P, sn, gs, a, d : 3.38463E-12 -1.69231E-12 1.69231E-12 1.70663E-12 1.00846E+00 3.38673E-04 -3.38463E-12 1.00853E+00 8.73771E-02 CONVERGENCE: FRTOL TEST SATISFIED value: 3.26981104411813 nfev, nfghev: 2 2 Final value: 3.269811 After optimisation: 1 1.00000E-04 1.75382E+01 9.99900E+03 5.14068E-09 2 0.00000E+00 2.32401E+01 9.99000E+02 -3.26634E-08 3 1.00000E-04 9.77352E-01 9.99000E+02 -1.81758E-07 4 0.00000E+00 4.12799E+01 9.99000E+02 -1.23705E-09 5 0.00000E+00 4.07009E+00 9.99000E+02 -2.77364E-09 6 -9.99000E+02 -1.82191E+01 9.99000E+02 1.72366E-10 7 -9.99000E+02 5.91798E+00 9.99000E+02 -5.83917E-10 nvar, nfree, nbind: 7 7 0 Final model : 3.269811 2.98E-13 3 1 Laue 17.53819 1 0.00010 9999.00000 1 1 K_over T 17.53862 0.06666 23.24007 1 0.00000 999.00000 2 2 B_frag_imp T 23.26646 0.42845 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 0.97735 1 0.00010 999.00000 6 3 K_solv T 0.97671 0.01826 41.27988 1 0.00000 999.00000 7 4 B_solv T 41.19829 4.56918 1.0 -1 1.0 1.0 0 K_solv_imp F 4.07009 1 0.00000 999.00000 8 5 B_solv_imp T 4.05352 3.76326 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -18.21909 1 -999.00000 999.00000 10 6 B11_over T -18.22321 0.34128 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.91798 1 -999.00000 999.00000 12 7 B22_over T 5.92289 0.33414 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 12.30110 -1 -999.00000 999.00000 15 B33_over F 12.30033 0.00000