Details of MaxLik refinement

Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 17.15104 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 3.95074 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 0.90873 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 32.97661 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 39.67022 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 -17.91262 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 5.02815 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 12.88447 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 17.15104 3.95074 0.90873 32.97661 39.67022 -17.91262 5.02815 value: 2.88450680453447 0.125000000000000 2.439639554032407E-004 f,g S 2.88450680 0.00024396 f,g F 2.88450592 0.00024396 D1, D2, P, A, A/P, sn, gs, a, d : 1.77465E-06 -8.87327E-07 8.87327E-07 8.87891E-07 1.00064E+00 1.93493E-02 -1.77465E-06 1.00064E+00 1.93493E-02 f,g G 2.88450592 0.00000028 f,g F 2.88450592 0.00000028 D1, D2, P, A, A/P, sn, gs, a, d : 3.53797E-12 -1.76898E-12 1.76898E-12 1.76970E-12 1.00040E+00 5.86145E-05 -3.53797E-12 1.00040E+00 1.93616E-02 CONVERGENCE: FRTOL TEST SATISFIED value: 2.88450591664144 nfev, nfghev: 2 2 Final value: 2.884506 After optimisation: 1 1.00000E-04 1.71579E+01 9.99900E+03 -1.51528E-07 2 0.00000E+00 3.95481E+00 9.99000E+02 -1.77078E-07 3 1.00000E-04 9.08869E-01 9.99000E+02 1.63705E-07 4 0.00000E+00 3.29916E+01 9.99000E+02 1.34876E-09 5 0.00000E+00 3.96609E+01 9.99000E+02 -1.88747E-09 6 -9.99000E+02 -1.79120E+01 9.99000E+02 -1.08299E-10 7 -9.99000E+02 5.02841E+00 9.99000E+02 7.70073E-10 nvar, nfree, nbind: 7 7 0 Final model : 2.884506 1.88E-12 3 1 Laue 17.15787 1 0.00010 9999.00000 1 1 K_over T 17.15104 0.04260 3.95481 1 0.00000 999.00000 2 2 B_frag_imp T 3.95074 0.07944 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 0.90887 1 0.00010 999.00000 6 3 K_solv T 0.90873 0.01574 32.99164 1 0.00000 999.00000 7 4 B_solv T 32.97661 2.77362 1.0 -1 1.0 1.0 0 K_solv_imp F 39.66094 1 0.00000 999.00000 8 5 B_solv_imp T 39.67022 1.81793 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.91197 1 -999.00000 999.00000 10 6 B11_over T -17.91262 0.21904 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.02841 1 -999.00000 999.00000 12 7 B22_over T 5.02815 0.21199 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 12.88357 -1 -999.00000 999.00000 15 B33_over F 12.88447 0.00000