Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 17.17946 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 16.24594 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 0.94317 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 28.72390 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 19.30472 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 -18.57310 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 5.84722 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 12.72588 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 17.17946 16.24594 0.94317 28.72390 19.30472 -18.57310 5.84722 value: 3.21432559670961 0.125000000000000 3.066059050273750E-004 f,g S 3.21432560 0.00030661 f,g F 3.21432360 0.00030661 D1, D2, P, A, A/P, sn, gs, a, d : 4.01173E-06 -2.00586E-06 2.00586E-06 2.00008E-06 9.97115E-01 2.25521E-01 -4.01173E-06 9.97123E-01 1.25000E-01 f,g G 3.21432360 0.00000128 f,g F 3.21432360 0.00000128 D1, D2, P, A, A/P, sn, gs, a, d : 1.39187E-10 -6.95936E-11 6.95936E-11 6.95901E-11 9.99950E-01 2.01434E-03 -1.39187E-10 9.99950E-01 2.24872E-01 CONVERGENCE: FRTOL TEST SATISFIED value: 3.21432359656360 nfev, nfghev: 2 2 Final value: 3.214324 After optimisation: 1 1.00000E-04 1.71904E+01 9.99900E+03 2.69255E-07 2 0.00000E+00 1.61927E+01 9.99000E+02 -3.09425E-07 3 1.00000E-04 9.43348E-01 9.99000E+02 1.20963E-06 4 0.00000E+00 2.86400E+01 9.99000E+02 1.91072E-08 5 0.00000E+00 1.95076E+01 9.99000E+02 -4.17802E-09 6 -9.99000E+02 -1.85671E+01 9.99000E+02 1.05883E-08 7 -9.99000E+02 5.84212E+00 9.99000E+02 -3.07544E-09 nvar, nfree, nbind: 7 7 0 Final model : 3.214324 1.86E-11 3 1 Laue 17.19035 1 0.00010 9999.00000 1 1 K_over T 17.17946 0.06651 16.19271 1 0.00000 999.00000 2 2 B_frag_imp T 16.24594 0.30153 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 0.94335 1 0.00010 999.00000 6 3 K_solv T 0.94317 0.01795 28.64003 1 0.00000 999.00000 7 4 B_solv T 28.72390 3.66309 1.0 -1 1.0 1.0 0 K_solv_imp F 19.50756 1 0.00000 999.00000 8 5 B_solv_imp T 19.30472 2.91879 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -18.56707 1 -999.00000 999.00000 10 6 B11_over T -18.57310 0.32023 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.84212 1 -999.00000 999.00000 12 7 B22_over T 5.84722 0.31369 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 12.72495 -1 -999.00000 999.00000 15 B33_over F 12.72588 0.00000