Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 16.67719 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 4.54940 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 0.92015 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 30.26631 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 41.76410 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 -17.61935 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 5.01466 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 12.60469 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 16.67719 4.54940 0.92015 30.26631 41.76410 -17.61935 5.01466 value: 2.93871938599653 0.125000000000000 2.814379264986225E-004 f,g S 2.93871939 0.00028144 f,g F 2.93871836 0.00028144 D1, D2, P, A, A/P, sn, gs, a, d : 2.04123E-06 -1.02061E-06 1.02061E-06 1.02100E-06 1.00038E+00 2.65285E-02 -2.04123E-06 1.00038E+00 2.65285E-02 f,g G 2.93871836 0.00000018 f,g F 2.93871836 0.00000018 D1, D2, P, A, A/P, sn, gs, a, d : 3.18511E-12 -1.59256E-12 1.59256E-12 1.57785E-12 9.90765E-01 3.05212E-04 -3.18511E-12 9.90850E-01 2.65385E-02 CONVERGENCE: FRTOL TEST SATISFIED value: 2.93871836499788 nfev, nfghev: 2 2 Final value: 2.938718 After optimisation: 1 1.00000E-04 1.66850E+01 9.99900E+03 -9.87543E-08 2 0.00000E+00 4.55206E+00 9.99000E+02 -1.37233E-07 3 1.00000E-04 9.20383E-01 9.99000E+02 6.06682E-08 4 0.00000E+00 3.02834E+01 9.99000E+02 -2.27224E-10 5 0.00000E+00 4.17828E+01 9.99000E+02 -1.61299E-09 6 -9.99000E+02 -1.76185E+01 9.99000E+02 7.66738E-10 7 -9.99000E+02 5.01309E+00 9.99000E+02 -1.30756E-09 nvar, nfree, nbind: 7 7 0 Final model : 2.938718 1.02E-12 3 1 Laue 16.68499 1 0.00010 9999.00000 1 1 K_over T 16.67719 0.04534 4.55206 1 0.00000 999.00000 2 2 B_frag_imp T 4.54940 0.09478 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 0.92038 1 0.00010 999.00000 6 3 K_solv T 0.92015 0.01587 30.28336 1 0.00000 999.00000 7 4 B_solv T 30.26631 2.86936 1.0 -1 1.0 1.0 0 K_solv_imp F 41.78276 1 0.00000 999.00000 8 5 B_solv_imp T 41.76410 1.96322 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.61852 1 -999.00000 999.00000 10 6 B11_over T -17.61935 0.23353 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.01309 1 -999.00000 999.00000 12 7 B22_over T 5.01466 0.22602 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 12.60544 -1 -999.00000 999.00000 15 B33_over F 12.60469 0.00000