Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 16.60250 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 15.04432 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 0.96820 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 27.38515 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 25.99032 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 -17.60516 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 5.37698 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 12.22818 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 16.60250 15.04432 0.96820 27.38515 25.99032 -17.60516 5.37698 value: 3.19665388346712 0.125000000000000 2.382773488118505E-005 f,g S 3.19665388 0.00002383 f,g F 3.19665386 0.00002383 D1, D2, P, A, A/P, sn, gs, a, d : 4.52573E-08 -2.26287E-08 2.26287E-08 2.26177E-08 9.99513E-01 7.82105E-03 -4.52573E-08 9.99513E-01 7.82105E-03 f,g G 3.19665386 0.00000002 f,g F 3.19665386 0.00000002 D1, D2, P, A, A/P, sn, gs, a, d : 2.82407E-14 -1.41203E-14 1.41203E-14 8.43769E-15 5.97556E-01 9.15579E-06 -2.82407E-14 7.13041E-01 7.82105E-03 CONVERGENCE: FRTOL TEST SATISFIED value: 3.19665386084946 nfev, nfghev: 2 2 Final value: 3.196654 After optimisation: 1 1.00000E-04 1.66030E+01 9.99900E+03 4.17604E-09 2 0.00000E+00 1.50382E+01 9.99000E+02 -5.24802E-09 3 1.00000E-04 9.68199E-01 9.99000E+02 1.43925E-08 4 0.00000E+00 2.73820E+01 9.99000E+02 1.77772E-10 5 0.00000E+00 2.59938E+01 9.99000E+02 -1.49591E-10 6 -9.99000E+02 -1.76042E+01 9.99000E+02 1.30344E-10 7 -9.99000E+02 5.37638E+00 9.99000E+02 -8.10698E-12 nvar, nfree, nbind: 7 7 0 Final model : 3.196654 1.02E-14 3 1 Laue 16.60301 1 0.00010 9999.00000 1 1 K_over T 16.60250 0.06610 15.03823 1 0.00000 999.00000 2 2 B_frag_imp T 15.04432 0.28022 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 0.96820 1 0.00010 999.00000 6 3 K_solv T 0.96820 0.01832 27.38197 1 0.00000 999.00000 7 4 B_solv T 27.38515 3.89117 1.0 -1 1.0 1.0 0 K_solv_imp F 25.99383 1 0.00000 999.00000 8 5 B_solv_imp T 25.99032 3.00189 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.60416 1 -999.00000 999.00000 10 6 B11_over T -17.60516 0.31948 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.37638 1 -999.00000 999.00000 12 7 B22_over T 5.37698 0.31123 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 12.22777 -1 -999.00000 999.00000 15 B33_over F 12.22818 0.00000