Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 16.97007 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 4.16325 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 0.91994 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 31.40687 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 43.58497 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 -17.80373 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 5.02859 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 12.77514 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 16.97007 4.16325 0.91994 31.40687 43.58497 -17.80373 5.02859 value: 2.90769305264685 0.125000000000000 4.123028671058975E-004 f,g S 2.90769305 0.00041230 f,g F 2.90769048 0.00041230 D1, D2, P, A, A/P, sn, gs, a, d : 5.13580E-06 -2.56790E-06 2.56790E-06 2.57036E-06 1.00096E+00 6.42912E-02 -5.13580E-06 1.00096E+00 6.42912E-02 f,g G 2.90769048 0.00000079 f,g F 2.90769048 0.00000079 D1, D2, P, A, A/P, sn, gs, a, d : 2.65630E-11 -1.32815E-11 1.32815E-11 1.32809E-11 9.99956E-01 4.83465E-04 -2.65630E-11 9.99956E-01 6.43528E-02 CONVERGENCE: FRTOL TEST SATISFIED value: 2.90769048227745 nfev, nfghev: 2 2 Final value: 2.907690 After optimisation: 1 1.00000E-04 1.69823E+01 9.99900E+03 -3.88703E-07 2 0.00000E+00 4.16885E+00 9.99000E+02 -4.45029E-07 3 1.00000E-04 9.20046E-01 9.99000E+02 5.30431E-07 4 0.00000E+00 3.14396E+01 9.99000E+02 2.06940E-09 5 0.00000E+00 4.36389E+01 9.99000E+02 -5.45628E-09 6 -9.99000E+02 -1.78059E+01 9.99000E+02 -1.77431E-09 7 -9.99000E+02 5.02893E+00 9.99000E+02 -2.92188E-10 nvar, nfree, nbind: 7 7 0 Final model : 2.907690 1.23E-11 3 1 Laue 16.98227 1 0.00010 9999.00000 1 1 K_over T 16.97007 0.04407 4.16885 1 0.00000 999.00000 2 2 B_frag_imp T 4.16325 0.08669 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 0.92005 1 0.00010 999.00000 6 3 K_solv T 0.91994 0.01596 31.43960 1 0.00000 999.00000 7 4 B_solv T 31.40687 2.86748 1.0 -1 1.0 1.0 0 K_solv_imp F 43.63888 1 0.00000 999.00000 8 5 B_solv_imp T 43.58497 1.97077 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.80594 1 -999.00000 999.00000 10 6 B11_over T -17.80373 0.22445 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.02893 1 -999.00000 999.00000 12 7 B22_over T 5.02859 0.21727 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 12.77701 -1 -999.00000 999.00000 15 B33_over F 12.77514 0.00000