Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 18.34922 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 19.14463 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 1.02935 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 32.24631 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 21.52568 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 -17.67913 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 5.52558 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 12.15355 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 18.34922 19.14463 1.02935 32.24631 21.52568 -17.67913 5.52558 value: 3.21165547021683 0.125000000000000 1.499576750673325E-004 f,g S 3.21165547 0.00014996 f,g F 3.21165463 0.00014996 D1, D2, P, A, A/P, sn, gs, a, d : 1.67274E-06 -8.36368E-07 8.36368E-07 8.35249E-07 9.98662E-01 1.54948E-01 -1.67274E-06 9.98664E-01 1.25000E-01 f,g G 3.21165463 0.00000033 f,g F 3.21165463 0.00000033 D1, D2, P, A, A/P, sn, gs, a, d : 1.49996E-11 -7.49978E-12 7.49978E-12 7.50289E-12 1.00041E+00 1.02945E-03 -1.49996E-11 1.00041E+00 1.54741E-01 CONVERGENCE: FRTOL TEST SATISFIED value: 3.21165463496022 nfev, nfghev: 2 2 Final value: 3.211655 After optimisation: 1 1.00000E-04 1.83579E+01 9.99900E+03 7.29588E-08 2 0.00000E+00 1.91116E+01 9.99000E+02 -9.07906E-08 3 1.00000E-04 1.02961E+00 9.99000E+02 3.10545E-07 4 0.00000E+00 3.21806E+01 9.99000E+02 4.95051E-09 5 0.00000E+00 2.16620E+01 9.99000E+02 -8.70236E-10 6 -9.99000E+02 -1.76710E+01 9.99000E+02 4.26325E-09 7 -9.99000E+02 5.51734E+00 9.99000E+02 -4.47560E-09 nvar, nfree, nbind: 7 7 0 Final model : 3.211655 3.85E-12 3 1 Laue 18.35789 1 0.00010 9999.00000 1 1 K_over T 18.34922 0.07042 19.11155 1 0.00000 999.00000 2 2 B_frag_imp T 19.14463 0.31217 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 1.02961 1 0.00010 999.00000 6 3 K_solv T 1.02935 0.02074 32.18063 1 0.00000 999.00000 7 4 B_solv T 32.24631 4.66151 1.0 -1 1.0 1.0 0 K_solv_imp F 21.66202 1 0.00000 999.00000 8 5 B_solv_imp T 21.52568 3.89911 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.67103 1 -999.00000 999.00000 10 6 B11_over T -17.67913 0.32595 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.51734 1 -999.00000 999.00000 12 7 B22_over T 5.52558 0.31769 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 12.15369 -1 -999.00000 999.00000 15 B33_over F 12.15355 0.00000