Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 17.91529 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 5.10641 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 0.86797 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 26.80990 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 35.63681 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 -18.35239 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 5.36821 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 12.98417 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 17.91529 5.10641 0.86797 26.80990 35.63681 -18.35239 5.36821 value: 2.96389874338757 0.125000000000000 1.699353308811987E-005 f,g S 2.96389874 0.00001699 f,g F 2.96389874 0.00001699 D1, D2, P, A, A/P, sn, gs, a, d : 9.33272E-09 -4.66636E-09 4.66636E-09 4.66646E-09 1.00002E+00 7.61480E-03 -9.33272E-09 1.00002E+00 7.61480E-03 f,g G 2.96389874 0.00000000 f,g F 2.96389874 0.00000000 D1, D2, P, A, A/P, sn, gs, a, d : 2.84937E-16 -1.42468E-16 1.42468E-16 -7.54952E-15 -5.29909E+01 7.03131E-06 -2.84937E-16 2.50000E-01 7.61497E-03 CONVERGENCE: FRTOL TEST SATISFIED value: 2.96389873872111 nfev, nfghev: 2 2 Final value: 2.963899 After optimisation: 1 1.00000E-04 1.79159E+01 9.99900E+03 -2.51708E-10 2 0.00000E+00 5.10624E+00 9.99000E+02 -5.27587E-10 3 1.00000E-04 8.67993E-01 9.99000E+02 3.11478E-09 4 0.00000E+00 2.68046E+01 9.99000E+02 5.27559E-11 5 0.00000E+00 3.56422E+01 9.99000E+02 -7.29467E-12 6 -9.99000E+02 -1.83523E+01 9.99000E+02 1.34266E-11 7 -9.99000E+02 5.36823E+00 9.99000E+02 3.75295E-12 nvar, nfree, nbind: 7 7 0 Final model : 2.963899 3.17E-09 3 1 Laue 17.91593 1 0.00010 9999.00000 1 1 K_over T 17.91529 0.05188 5.10624 1 0.00000 999.00000 2 2 B_frag_imp T 5.10641 0.10286 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 0.86799 1 0.00010 999.00000 6 3 K_solv T 0.86797 0.01534 26.80455 1 0.00000 999.00000 7 4 B_solv T 26.80990 2.88715 1.0 -1 1.0 1.0 0 K_solv_imp F 35.64219 1 0.00000 999.00000 8 5 B_solv_imp T 35.63681 1.86950 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -18.35233 1 -999.00000 999.00000 10 6 B11_over T -18.35239 0.24203 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.36823 1 -999.00000 999.00000 12 7 B22_over T 5.36821 0.23463 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 12.98409 -1 -999.00000 999.00000 15 B33_over F 12.98417 0.00000