Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 16.22556 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 9.10932 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 0.94401 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 25.80282 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 35.87482 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 -17.41954 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 4.91673 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 12.50281 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 16.22556 9.10932 0.94401 25.80282 35.87482 -17.41954 4.91673 value: 3.09744619227152 0.125000000000000 8.395748377790512E-004 f,g S 3.09744619 0.00083957 f,g F 3.09743859 0.00083957 D1, D2, P, A, A/P, sn, gs, a, d : 1.52405E-05 -7.62026E-06 7.62026E-06 7.60423E-06 9.97896E-01 1.71247E-01 -1.52405E-05 9.97901E-01 1.25000E-01 f,g G 3.09743859 0.00000161 f,g F 3.09743859 0.00000161 D1, D2, P, A, A/P, sn, gs, a, d : 1.34312E-09 -6.71558E-10 6.71558E-10 6.71498E-10 9.99911E-01 1.50133E-02 -1.34312E-09 9.99911E-01 1.70888E-01 CONVERGENCE: FRTOL TEST SATISFIED value: 3.09743858736631 nfev, nfghev: 2 2 Final value: 3.097439 After optimisation: 1 1.00000E-04 1.62432E+01 9.99900E+03 9.52852E-07 2 0.00000E+00 9.08092E+00 9.99000E+02 -1.16836E-06 3 1.00000E-04 9.44437E-01 9.99000E+02 -5.61738E-07 4 0.00000E+00 2.59816E+01 9.99000E+02 -2.38561E-08 5 0.00000E+00 3.58500E+01 9.99000E+02 -1.87775E-08 6 -9.99000E+02 -1.74048E+01 9.99000E+02 5.25873E-08 7 -9.99000E+02 4.90710E+00 9.99000E+02 -1.13014E-08 nvar, nfree, nbind: 7 7 0 Final model : 3.097439 1.06E-09 3 1 Laue 16.24318 1 0.00010 9999.00000 1 1 K_over T 16.22556 0.05793 9.08092 1 0.00000 999.00000 2 2 B_frag_imp T 9.10932 0.17982 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 0.94444 1 0.00010 999.00000 6 3 K_solv T 0.94401 0.01720 25.98163 1 0.00000 999.00000 7 4 B_solv T 25.80282 3.28547 1.0 -1 1.0 1.0 0 K_solv_imp F 35.85000 1 0.00000 999.00000 8 5 B_solv_imp T 35.87482 2.42996 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.40485 1 -999.00000 999.00000 10 6 B11_over T -17.41954 0.28588 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 4.90710 1 -999.00000 999.00000 12 7 B22_over T 4.91673 0.27755 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 12.49775 -1 -999.00000 999.00000 15 B33_over F 12.50281 0.00000