Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 17.20901 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 4.10874 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 0.92016 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 30.76250 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 45.80312 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 -17.89518 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 5.06919 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 12.82599 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 17.20901 4.10874 0.92016 30.76250 45.80312 -17.89518 5.06919 value: 2.89813447229584 0.125000000000000 3.428115389051833E-005 f,g S 2.89813447 0.00003428 f,g F 2.89813446 0.00003428 D1, D2, P, A, A/P, sn, gs, a, d : 2.75865E-08 -1.37932E-08 1.37932E-08 1.37892E-08 9.99707E-01 1.61380E-02 -2.75865E-08 9.99708E-01 1.61380E-02 f,g G 2.89813446 0.00000001 f,g F 2.89813446 0.00000001 D1, D2, P, A, A/P, sn, gs, a, d : 6.23793E-15 -3.11896E-15 3.11896E-15 -3.99680E-15 -1.28145E+00 6.87776E-06 -6.23793E-15 3.04743E-01 1.61380E-02 CONVERGENCE: FRTOL TEST SATISFIED value: 2.89813445850664 nfev, nfghev: 2 2 Final value: 2.898134 After optimisation: 1 1.00000E-04 1.72084E+01 9.99900E+03 -2.57410E-09 2 0.00000E+00 4.10778E+00 9.99000E+02 -7.46948E-09 3 1.00000E-04 9.20168E-01 9.99000E+02 8.62283E-09 4 0.00000E+00 3.07678E+01 9.99000E+02 5.80689E-11 5 0.00000E+00 4.57880E+01 9.99000E+02 -1.85709E-10 6 -9.99000E+02 -1.78940E+01 9.99000E+02 5.36105E-11 7 -9.99000E+02 5.06818E+00 9.99000E+02 -4.74786E-11 nvar, nfree, nbind: 7 7 0 Final model : 2.898134 1.17E-08 3 1 Laue 17.20838 1 0.00010 9999.00000 1 1 K_over T 17.20901 0.04441 4.10778 1 0.00000 999.00000 2 2 B_frag_imp T 4.10874 0.08699 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 0.92017 1 0.00010 999.00000 6 3 K_solv T 0.92016 0.01610 30.76784 1 0.00000 999.00000 7 4 B_solv T 30.76250 2.86006 1.0 -1 1.0 1.0 0 K_solv_imp F 45.78802 1 0.00000 999.00000 8 5 B_solv_imp T 45.80312 2.02024 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.89396 1 -999.00000 999.00000 10 6 B11_over T -17.89518 0.22139 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.06818 1 -999.00000 999.00000 12 7 B22_over T 5.06919 0.21431 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 12.82577 -1 -999.00000 999.00000 15 B33_over F 12.82599 0.00000