Details of MaxLik refinement

Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 16.59181 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 2.57230 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 0.89758 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 32.39593 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 27.57498 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 -17.93542 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 4.98664 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 12.94878 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 16.59181 2.57230 0.89758 32.39593 27.57498 -17.93542 4.98664 value: 2.77366022623225 0.125000000000000 1.720430622629759E-004 f,g S 2.77366023 0.00017204 f,g F 2.77365994 0.00017204 D1, D2, P, A, A/P, sn, gs, a, d : 5.80058E-07 -2.90029E-07 2.90029E-07 2.90061E-07 1.00011E+00 7.12260E-02 -5.80058E-07 1.00011E+00 7.12260E-02 f,g G 2.77365994 0.00000033 f,g F 2.77365994 0.00000033 D1, D2, P, A, A/P, sn, gs, a, d : 1.88046E-12 -9.40228E-13 9.40228E-13 9.29035E-13 9.88095E-01 4.00278E-04 -1.88046E-12 9.88235E-01 7.12339E-02 CONVERGENCE: FRTOL TEST SATISFIED value: 2.77365993617060 nfev, nfghev: 2 2 Final value: 2.773660 After optimisation: 1 1.00000E-04 1.65951E+01 9.99900E+03 1.58291E-08 2 0.00000E+00 2.56971E+00 9.99000E+02 -8.78760E-08 3 1.00000E-04 8.97839E-01 9.99000E+02 3.15066E-07 4 0.00000E+00 3.23298E+01 9.99000E+02 6.02669E-09 5 0.00000E+00 2.76020E+01 9.99000E+02 -2.35480E-09 6 -9.99000E+02 -1.79377E+01 9.99000E+02 -6.96442E-10 7 -9.99000E+02 4.98863E+00 9.99000E+02 1.25152E-09 nvar, nfree, nbind: 7 7 0 Final model : 2.773660 3.28E-12 3 1 Laue 16.59510 1 0.00010 9999.00000 1 1 K_over T 16.59181 0.03493 2.56971 1 0.00000 999.00000 2 2 B_frag_imp T 2.57230 0.05319 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 0.89784 1 0.00010 999.00000 6 3 K_solv T 0.89758 0.01269 32.32981 1 0.00000 999.00000 7 4 B_solv T 32.39593 2.06797 1.0 -1 1.0 1.0 0 K_solv_imp F 27.60203 1 0.00000 999.00000 8 5 B_solv_imp T 27.57498 1.21664 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.93768 1 -999.00000 999.00000 10 6 B11_over T -17.93542 0.19234 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 4.98863 1 -999.00000 999.00000 12 7 B22_over T 4.98664 0.18466 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 12.94904 -1 -999.00000 999.00000 15 B33_over F 12.94878 0.00000