Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 17.24512 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 5.16074 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 0.93335 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 29.35121 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 44.68288 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 -17.59430 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 5.00372 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 12.59058 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 17.24512 5.16074 0.93335 29.35121 44.68288 -17.59430 5.00372 value: 2.94567545709049 0.125000000000000 2.477471232835217E-004 f,g S 2.94567546 0.00024775 f,g F 2.94567475 0.00024775 D1, D2, P, A, A/P, sn, gs, a, d : 1.42039E-06 -7.10194E-07 7.10194E-07 7.10023E-07 9.99759E-01 1.01800E-01 -1.42039E-06 9.99759E-01 1.01800E-01 f,g G 2.94567475 0.00000033 f,g F 2.94567475 0.00000033 D1, D2, P, A, A/P, sn, gs, a, d : 2.56135E-12 -1.28068E-12 1.28068E-12 1.27498E-12 9.95553E-01 3.67670E-04 -2.56135E-12 9.95572E-01 1.01800E-01 CONVERGENCE: FRTOL TEST SATISFIED value: 2.94567474706629 nfev, nfghev: 2 2 Final value: 2.945675 After optimisation: 1 1.00000E-04 1.72519E+01 9.99900E+03 4.79111E-08 2 0.00000E+00 5.15712E+00 9.99000E+02 -1.25059E-07 3 1.00000E-04 9.33472E-01 9.99000E+02 3.03079E-07 4 0.00000E+00 2.93324E+01 9.99000E+02 4.95733E-09 5 0.00000E+00 4.47828E+01 9.99000E+02 -2.16655E-09 6 -9.99000E+02 -1.75930E+01 9.99000E+02 5.07544E-09 7 -9.99000E+02 5.00458E+00 9.99000E+02 2.26898E-09 nvar, nfree, nbind: 7 7 0 Final model : 2.945675 1.43E-12 3 1 Laue 17.25186 1 0.00010 9999.00000 1 1 K_over T 17.24512 0.04795 5.15712 1 0.00000 999.00000 2 2 B_frag_imp T 5.16074 0.10436 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 0.93347 1 0.00010 999.00000 6 3 K_solv T 0.93335 0.01653 29.33239 1 0.00000 999.00000 7 4 B_solv T 29.35121 2.94393 1.0 -1 1.0 1.0 0 K_solv_imp F 44.78285 1 0.00000 999.00000 8 5 B_solv_imp T 44.68288 2.11062 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.59297 1 -999.00000 999.00000 10 6 B11_over T -17.59430 0.23592 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.00458 1 -999.00000 999.00000 12 7 B22_over T 5.00372 0.22842 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 12.58839 -1 -999.00000 999.00000 15 B33_over F 12.59058 0.00000