Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 17.59023 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 22.19601 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 0.99623 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 40.33957 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 6.36599 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 -18.12656 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 5.84981 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 12.27675 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 17.59023 22.19601 0.99623 40.33957 6.36599 -18.12656 5.84981 value: 3.25914400109883 0.125000000000000 2.457949475456239E-004 f,g S 3.25914400 0.00024579 f,g F 3.25914293 0.00024579 D1, D2, P, A, A/P, sn, gs, a, d : 2.14331E-06 -1.07166E-06 1.07166E-06 1.06962E-06 9.98097E-01 2.61973E-01 -2.14331E-06 9.98100E-01 1.25000E-01 f,g G 3.25914293 0.00000030 f,g F 3.25914293 0.00000030 D1, D2, P, A, A/P, sn, gs, a, d : 5.08498E-11 -2.54249E-11 2.54249E-11 2.54263E-11 1.00006E+00 2.02123E-03 -5.08498E-11 1.00006E+00 2.61475E-01 CONVERGENCE: FRTOL TEST SATISFIED value: 3.25914293145773 nfev, nfghev: 2 2 Final value: 3.259143 After optimisation: 1 1.00000E-04 1.75982E+01 9.99900E+03 1.37669E-07 2 0.00000E+00 2.21431E+01 9.99000E+02 -1.32256E-07 3 1.00000E-04 9.96924E-01 9.99000E+02 -2.34170E-07 4 0.00000E+00 4.01993E+01 9.99000E+02 5.80134E-09 5 0.00000E+00 6.58220E+00 9.99000E+02 -5.14629E-09 6 -9.99000E+02 -1.81176E+01 9.99000E+02 7.74806E-09 7 -9.99000E+02 5.84627E+00 9.99000E+02 1.29841E-09 nvar, nfree, nbind: 7 7 0 Final model : 3.259143 3.42E-11 3 1 Laue 17.59821 1 0.00010 9999.00000 1 1 K_over T 17.59023 0.06679 22.14307 1 0.00000 999.00000 2 2 B_frag_imp T 22.19601 0.39398 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 0.99692 1 0.00010 999.00000 6 3 K_solv T 0.99623 0.01861 40.19933 1 0.00000 999.00000 7 4 B_solv T 40.33957 4.61742 1.0 -1 1.0 1.0 0 K_solv_imp F 6.58220 1 0.00000 999.00000 8 5 B_solv_imp T 6.36599 3.78456 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -18.11763 1 -999.00000 999.00000 10 6 B11_over T -18.12656 0.33913 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.84627 1 -999.00000 999.00000 12 7 B22_over T 5.84981 0.33183 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 12.27136 -1 -999.00000 999.00000 15 B33_over F 12.27675 0.00000