Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 17.06153 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 6.29000 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 0.93246 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 28.71789 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 41.07963 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 -17.35023 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 4.94025 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 12.40998 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 17.06153 6.29000 0.93246 28.71789 41.07963 -17.35023 4.94025 value: 2.99025668700212 0.125000000000000 6.405878451779645E-005 f,g S 2.99025669 0.00006406 f,g F 2.99025636 0.00006406 D1, D2, P, A, A/P, sn, gs, a, d : 6.48286E-07 -3.24143E-07 3.24143E-07 3.23604E-07 9.98338E-01 5.01725E-02 -6.48286E-07 9.98341E-01 5.01725E-02 f,g G 2.99025636 0.00000026 f,g F 2.99025636 0.00000026 D1, D2, P, A, A/P, sn, gs, a, d : 4.57620E-12 -2.28810E-12 2.28810E-12 2.28528E-12 9.98769E-01 1.64339E-04 -4.57620E-12 9.98771E-01 5.01725E-02 CONVERGENCE: FRTOL TEST SATISFIED value: 2.99025636339535 nfev, nfghev: 2 2 Final value: 2.990256 After optimisation: 1 1.00000E-04 1.70602E+01 9.99900E+03 -3.27875E-08 2 0.00000E+00 6.27873E+00 9.99000E+02 -1.51338E-07 3 1.00000E-04 9.32345E-01 9.99000E+02 2.07347E-07 4 0.00000E+00 2.86696E+01 9.99000E+02 3.06064E-09 5 0.00000E+00 4.10779E+01 9.99000E+02 -3.25079E-09 6 -9.99000E+02 -1.73555E+01 9.99000E+02 -2.79454E-09 7 -9.99000E+02 4.94580E+00 9.99000E+02 2.81074E-09 nvar, nfree, nbind: 7 7 0 Final model : 2.990256 1.83E-12 3 1 Laue 17.06024 1 0.00010 9999.00000 1 1 K_over T 17.06153 0.05069 6.27873 1 0.00000 999.00000 2 2 B_frag_imp T 6.29000 0.12229 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 0.93235 1 0.00010 999.00000 6 3 K_solv T 0.93246 0.01680 28.66955 1 0.00000 999.00000 7 4 B_solv T 28.71789 2.94152 1.0 -1 1.0 1.0 0 K_solv_imp F 41.07794 1 0.00000 999.00000 8 5 B_solv_imp T 41.07963 2.13318 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.35550 1 -999.00000 999.00000 10 6 B11_over T -17.35023 0.25076 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 4.94580 1 -999.00000 999.00000 12 7 B22_over T 4.94025 0.24283 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 12.40970 -1 -999.00000 999.00000 15 B33_over F 12.40998 0.00000