Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 16.82305 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 3.62013 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 0.91522 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 31.67292 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 40.81653 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 -17.93110 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 5.00631 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 12.92479 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 16.82305 3.62013 0.91522 31.67292 40.81653 -17.93110 5.00631 value: 2.87965646013386 0.125000000000000 1.831663623051775E-004 f,g S 2.87965646 0.00018317 f,g F 2.87965605 0.00018317 D1, D2, P, A, A/P, sn, gs, a, d : 8.24904E-07 -4.12452E-07 4.12452E-07 4.12599E-07 1.00036E+00 2.44556E-02 -8.24904E-07 1.00036E+00 2.44556E-02 f,g G 2.87965605 0.00000011 f,g F 2.87965605 0.00000011 D1, D2, P, A, A/P, sn, gs, a, d : 6.89556E-13 -3.44778E-13 3.44778E-13 3.37508E-13 9.78913E-01 9.70247E-05 -6.89556E-13 9.79348E-01 2.44644E-02 CONVERGENCE: FRTOL TEST SATISFIED value: 2.87965604753463 nfev, nfghev: 2 2 Final value: 2.879656 After optimisation: 1 1.00000E-04 1.68277E+01 9.99900E+03 -5.88620E-08 2 0.00000E+00 3.62199E+00 9.99000E+02 -7.96901E-08 3 1.00000E-04 9.15381E-01 9.99000E+02 3.80045E-08 4 0.00000E+00 3.16820E+01 9.99000E+02 1.91501E-11 5 0.00000E+00 4.08387E+01 9.99000E+02 -1.10890E-09 6 -9.99000E+02 -1.79309E+01 9.99000E+02 -5.25893E-11 7 -9.99000E+02 5.00546E+00 9.99000E+02 -3.11962E-10 nvar, nfree, nbind: 7 7 0 Final model : 2.879656 2.90E-13 3 1 Laue 16.82773 1 0.00010 9999.00000 1 1 K_over T 16.82305 0.04163 3.62199 1 0.00000 999.00000 2 2 B_frag_imp T 3.62013 0.07659 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 0.91538 1 0.00010 999.00000 6 3 K_solv T 0.91522 0.01534 31.68203 1 0.00000 999.00000 7 4 B_solv T 31.67292 2.73340 1.0 -1 1.0 1.0 0 K_solv_imp F 40.83867 1 0.00000 999.00000 8 5 B_solv_imp T 40.81653 1.80441 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.93093 1 -999.00000 999.00000 10 6 B11_over T -17.93110 0.21678 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.00546 1 -999.00000 999.00000 12 7 B22_over T 5.00631 0.20950 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 12.92547 -1 -999.00000 999.00000 15 B33_over F 12.92479 0.00000