Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 17.15302 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 4.22291 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 0.92092 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 31.68264 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 44.54698 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 -17.82711 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 5.02050 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 12.80661 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 17.15302 4.22291 0.92092 31.68264 44.54698 -17.82711 5.02050 value: 2.90396605953071 0.125000000000000 1.717052306895365E-004 f,g S 2.90396606 0.00017171 f,g F 2.90396565 0.00017171 D1, D2, P, A, A/P, sn, gs, a, d : 8.13092E-07 -4.06546E-07 4.06546E-07 4.06570E-07 1.00006E+00 4.36221E-02 -8.13092E-07 1.00006E+00 4.36221E-02 f,g G 2.90396565 0.00000022 f,g F 2.90396565 0.00000022 D1, D2, P, A, A/P, sn, gs, a, d : 5.69297E-13 -2.84648E-13 2.84648E-13 2.86438E-13 1.00629E+00 1.90735E-04 -5.69297E-13 1.00633E+00 4.36247E-02 CONVERGENCE: FRTOL TEST SATISFIED value: 2.90396565296014 nfev, nfghev: 2 2 Final value: 2.903966 After optimisation: 1 1.00000E-04 1.71580E+01 9.99900E+03 -1.34397E-08 2 0.00000E+00 4.22228E+00 9.99000E+02 -6.38869E-08 3 1.00000E-04 9.20966E-01 9.99000E+02 2.05041E-07 4 0.00000E+00 3.16680E+01 9.99000E+02 2.61085E-09 5 0.00000E+00 4.45879E+01 9.99000E+02 -4.94169E-10 6 -9.99000E+02 -1.78260E+01 9.99000E+02 1.89759E-09 7 -9.99000E+02 5.02038E+00 9.99000E+02 3.16910E-10 nvar, nfree, nbind: 7 7 0 Final model : 2.903966 3.41E-13 3 1 Laue 17.15805 1 0.00010 9999.00000 1 1 K_over T 17.15302 0.04430 4.22228 1 0.00000 999.00000 2 2 B_frag_imp T 4.22291 0.08692 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 0.92097 1 0.00010 999.00000 6 3 K_solv T 0.92092 0.01606 31.66800 1 0.00000 999.00000 7 4 B_solv T 31.68264 2.87780 1.0 -1 1.0 1.0 0 K_solv_imp F 44.58788 1 0.00000 999.00000 8 5 B_solv_imp T 44.54698 2.00262 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.82598 1 -999.00000 999.00000 10 6 B11_over T -17.82711 0.22352 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.02038 1 -999.00000 999.00000 12 7 B22_over T 5.02050 0.21637 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 12.80560 -1 -999.00000 999.00000 15 B33_over F 12.80661 0.00000