Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 17.02442 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 17.40885 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 0.94435 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 30.24209 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 15.71471 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 -18.65736 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 5.93143 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 12.72592 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 17.02442 17.40885 0.94435 30.24209 15.71471 -18.65736 5.93143 value: 3.23130177717053 0.125000000000000 3.684734481982534E-006 f,g S 3.23130178 0.00000368 f,g F 3.23130178 0.00000368 D1, D2, P, A, A/P, sn, gs, a, d : 1.40611E-09 -7.03057E-10 7.03057E-10 7.03015E-10 9.99940E-01 7.85609E-03 -1.40611E-09 9.99940E-01 7.85609E-03 CONVERGENCE: FRTOL TEST SATISFIED value: 3.23130177646752 nfev, nfghev: 1 1 Final value: 3.231302 After optimisation: 1 1.00000E-04 1.70246E+01 9.99900E+03 -2.56446E-06 2 0.00000E+00 1.74076E+01 9.99000E+02 6.71519E-07 3 1.00000E-04 9.44326E-01 9.99000E+02 -2.55387E-06 4 0.00000E+00 3.02411E+01 9.99000E+02 -5.86337E-08 5 0.00000E+00 1.57224E+01 9.99000E+02 -2.59234E-08 6 -9.99000E+02 -1.86577E+01 9.99000E+02 1.41513E-07 7 -9.99000E+02 5.93150E+00 9.99000E+02 5.89819E-08 nvar, nfree, nbind: 7 7 0 Final model : 3.231302 4.73E-10 3 1 Laue 17.02459 1 0.00010 9999.00000 1 1 K_over T 17.02442 0.06621 17.40757 1 0.00000 999.00000 2 2 B_frag_imp T 17.40885 0.32973 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 0.94433 1 0.00010 999.00000 6 3 K_solv T 0.94435 0.01773 30.24111 1 0.00000 999.00000 7 4 B_solv T 30.24209 3.74020 1.0 -1 1.0 1.0 0 K_solv_imp F 15.72239 1 0.00000 999.00000 8 5 B_solv_imp T 15.71471 2.97912 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -18.65767 1 -999.00000 999.00000 10 6 B11_over T -18.65736 0.32574 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.93150 1 -999.00000 999.00000 12 7 B22_over T 5.93143 0.31929 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 12.72618 -1 -999.00000 999.00000 15 B33_over F 12.72592 0.00000