Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 17.27034 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 13.18122 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 0.97251 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 27.50989 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 31.17816 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 -17.12258 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 4.96358 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 12.15900 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 17.27034 13.18122 0.97251 27.50989 31.17816 -17.12258 4.96358 value: 3.14338113841796 0.125000000000000 4.379311887515250E-004 f,g S 3.14338114 0.00043793 f,g F 3.14337718 0.00043793 D1, D2, P, A, A/P, sn, gs, a, d : 7.92359E-06 -3.96179E-06 3.96179E-06 3.95362E-06 9.97938E-01 1.66357E-01 -7.92359E-06 9.97942E-01 1.25000E-01 f,g G 3.14337718 0.00000167 f,g F 3.14337718 0.00000167 D1, D2, P, A, A/P, sn, gs, a, d : 1.64216E-10 -8.21081E-11 8.21081E-11 8.21241E-11 1.00020E+00 9.05381E-04 -1.64216E-10 1.00020E+00 1.66014E-01 CONVERGENCE: FRTOL TEST SATISFIED value: 3.14337718471107 nfev, nfghev: 2 2 Final value: 3.143377 After optimisation: 1 1.00000E-04 1.72879E+01 9.99900E+03 3.95773E-07 2 0.00000E+00 1.31425E+01 9.99000E+02 -4.64755E-07 3 1.00000E-04 9.72711E-01 9.99000E+02 1.55604E-06 4 0.00000E+00 2.74982E+01 9.99000E+02 2.00146E-08 5 0.00000E+00 3.13378E+01 9.99000E+02 -4.31465E-09 6 -9.99000E+02 -1.71239E+01 9.99000E+02 1.39581E-09 7 -9.99000E+02 4.96057E+00 9.99000E+02 -1.00003E-08 nvar, nfree, nbind: 7 7 0 Final model : 3.143377 6.46E-11 3 1 Laue 17.28791 1 0.00010 9999.00000 1 1 K_over T 17.27034 0.06378 13.14249 1 0.00000 999.00000 2 2 B_frag_imp T 13.18122 0.22738 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 0.97271 1 0.00010 999.00000 6 3 K_solv T 0.97251 0.01858 27.49821 1 0.00000 999.00000 7 4 B_solv T 27.50989 3.54162 1.0 -1 1.0 1.0 0 K_solv_imp F 31.33781 1 0.00000 999.00000 8 5 B_solv_imp T 31.17816 2.81926 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.12390 1 -999.00000 999.00000 10 6 B11_over T -17.12258 0.30473 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 4.96057 1 -999.00000 999.00000 12 7 B22_over T 4.96358 0.29566 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 12.16332 -1 -999.00000 999.00000 15 B33_over F 12.15900 0.00000