Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 17.72926 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 4.31715 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 0.85933 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 27.21153 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 35.90759 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 -18.22129 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 5.31780 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 12.90348 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 17.72926 4.31715 0.85933 27.21153 35.90759 -18.22129 5.31780 value: 2.92120491582904 0.125000000000000 4.411310490936466E-003 f,g S 2.92120492 0.00441131 f,g F 2.92108396 0.00441131 D1, D2, P, A, A/P, sn, gs, a, d : 2.52820E-04 -1.26410E-04 1.26410E-04 1.20952E-04 9.56826E-01 2.79053E-01 -2.52820E-04 9.58613E-01 1.25000E-01 f,g G 2.92108396 0.00019736 f,g F 2.92108346 0.00019736 D1, D2, P, A, A/P, sn, gs, a, d : 1.00441E-06 -5.02205E-07 5.02205E-07 5.03452E-07 1.00248E+00 4.98858E-02 -1.00441E-06 1.00249E+00 2.67504E-01 f,g G 2.92108346 0.00000087 f,g F 2.92108346 0.00000087 D1, D2, P, A, A/P, sn, gs, a, d : 1.62841E-11 -8.14205E-12 8.14205E-12 8.13793E-12 9.99495E-01 4.44408E-04 -1.62841E-11 9.99495E-01 2.67504E-01 CONVERGENCE: FRTOL TEST SATISFIED value: 2.92108346022396 nfev, nfghev: 3 3 Final value: 2.921083 After optimisation: 1 1.00000E-04 1.77026E+01 9.99900E+03 1.32504E-08 2 0.00000E+00 4.17734E+00 9.99000E+02 -4.17333E-07 3 1.00000E-04 8.59411E-01 9.99000E+02 7.62794E-07 4 0.00000E+00 2.74764E+01 9.99000E+02 1.24838E-08 5 0.00000E+00 3.58618E+01 9.99000E+02 -3.47816E-09 6 -9.99000E+02 -1.81868E+01 9.99000E+02 1.06490E-09 7 -9.99000E+02 5.29682E+00 9.99000E+02 6.46208E-10 nvar, nfree, nbind: 7 7 0 Final model : 2.921083 7.08E-12 3 1 Laue 17.70263 1 0.00010 9999.00000 1 1 K_over T 17.72926 0.04777 4.17734 1 0.00000 999.00000 2 2 B_frag_imp T 4.31715 0.08713 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 0.85941 1 0.00010 999.00000 6 3 K_solv T 0.85933 0.01460 27.47644 1 0.00000 999.00000 7 4 B_solv T 27.21153 2.63436 1.0 -1 1.0 1.0 0 K_solv_imp F 35.86183 1 0.00000 999.00000 8 5 B_solv_imp T 35.90759 1.71904 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -18.18682 1 -999.00000 999.00000 10 6 B11_over T -18.22129 0.22976 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.29682 1 -999.00000 999.00000 12 7 B22_over T 5.31780 0.22220 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 12.89000 -1 -999.00000 999.00000 15 B33_over F 12.90348 0.00000