Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 16.75489 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 3.76355 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 0.91150 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 30.11882 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 43.81982 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 -17.94811 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 5.10206 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 12.84605 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 16.75489 3.76355 0.91150 30.11882 43.81982 -17.94811 5.10206 value: 3.18998857985211 0.125000000000000 0.118511198029940 f,g S 3.18998858 0.11851120 f,g F 3.12917204 0.11851120 D1, D2, P, A, A/P, sn, gs, a, d : 7.13810E-02 -1.15093E-02 5.98717E-02 6.08165E-02 1.01578E+00 2.73571E+00 -7.13810E-02 3.37836E+00 1.25000E-01 f,g G 3.12917204 0.08245085 f,g F 3.02584155 0.08245085 D1, D2, P, A, A/P, sn, gs, a, d : 1.98412E-01 -8.24617E-02 1.15950E-01 1.03330E-01 8.91165E-01 6.78027E+01 -1.98412E-01 1.04338E+00 5.00000E-01 f,g G 3.02584155 0.03453470 f,g F 3.02077589 0.03453470 D1, D2, P, A, A/P, sn, gs, a, d : 3.43848E-02 -1.65366E-02 1.78482E-02 5.06566E-03 2.83819E-01 9.83658E+01 -3.43848E-02 5.86388E-01 2.00000E+00 f,g G 3.02077589 0.03951154 f,g F 3.00969228 0.03951154 D1, D2, P, A, A/P, sn, gs, a, d : 1.85919E-02 -9.29596E-03 9.29596E-03 1.10836E-02 1.19230E+00 1.45256E+01 -1.85919E-02 1.23809E+00 8.00000E+00 f,g G 3.00969228 0.01108561 f,g F 3.00703788 0.01108561 D1, D2, P, A, A/P, sn, gs, a, d : 4.33471E-03 -2.16735E-03 2.16735E-03 2.65440E-03 1.22472E+00 1.55282E+01 -4.33471E-03 1.28985E+00 1.79839E+01 f,g G 3.00703788 0.00317627 f,g F 3.00641544 0.00317627 D1, D2, P, A, A/P, sn, gs, a, d : 1.05883E-03 -5.29414E-04 5.29414E-04 6.22444E-04 1.17572E+00 1.25586E+01 -1.05883E-03 1.21318E+00 2.00291E+01 f,g G 3.00641544 0.00099805 f,g F 3.00635132 0.00099805 D1, D2, P, A, A/P, sn, gs, a, d : 1.19188E-04 -5.95942E-05 5.95942E-05 6.41182E-05 1.07591E+00 5.52648E+00 -1.19188E-04 1.08215E+00 2.00291E+01 f,g G 3.00635132 0.00013558 f,g F 3.00635037 0.00013558 D1, D2, P, A, A/P, sn, gs, a, d : 1.87792E-06 -9.38959E-07 9.38959E-07 9.49107E-07 1.01081E+00 7.48286E-01 -1.87792E-06 1.01093E+00 2.00291E+01 f,g G 3.00635037 0.00000223 f,g F 3.00635037 0.00000223 D1, D2, P, A, A/P, sn, gs, a, d : 5.06867E-10 -2.53434E-10 2.53434E-10 2.53472E-10 1.00015E+00 1.23574E-02 -5.06867E-10 1.00015E+00 2.00291E+01 CONVERGENCE: FRTOL TEST SATISFIED value: 3.00635037168205 nfev, nfghev: 9 9 Final value: 3.006350 After optimisation: 1 1.00000E-04 1.85292E+01 9.99900E+03 -6.13300E-07 2 0.00000E+00 9.28116E+00 9.99000E+02 1.10306E-07 3 1.00000E-04 1.03226E+00 9.99000E+02 -2.13845E-06 4 0.00000E+00 4.75824E+01 9.99000E+02 -4.81566E-08 5 0.00000E+00 4.07285E+01 9.99000E+02 -1.36788E-08 6 -9.99000E+02 -1.70362E+01 9.99000E+02 -5.39056E-09 7 -9.99000E+02 4.68819E+00 9.99000E+02 2.42692E-09 nvar, nfree, nbind: 7 7 0 Final model : 3.006350 5.98E-10 3 1 Laue 18.52915 1 0.00010 9999.00000 1 1 K_over T 16.75489 0.05301 9.28116 1 0.00000 999.00000 2 2 B_frag_imp T 3.76355 0.13309 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 1.03226 1 0.00010 999.00000 6 3 K_solv T 0.91150 0.01999 47.58240 1 0.00000 999.00000 7 4 B_solv T 30.11882 4.10713 1.0 -1 1.0 1.0 0 K_solv_imp F 40.72849 1 0.00000 999.00000 8 5 B_solv_imp T 43.81982 2.92801 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.03623 1 -999.00000 999.00000 10 6 B11_over T -17.94811 0.27037 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 4.68819 1 -999.00000 999.00000 12 7 B22_over T 5.10206 0.26174 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 12.34803 -1 -999.00000 999.00000 15 B33_over F 12.84605 0.00000