Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 17.13823 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 4.49748 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 0.92725 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 31.19634 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 43.64583 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 -17.71652 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 5.02277 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 12.69374 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 17.13823 4.49748 0.92725 31.19634 43.64583 -17.71652 5.02277 value: 2.91655118984784 0.125000000000000 2.138418105831067E-004 f,g S 2.91655119 0.00021384 f,g F 2.91655067 0.00021384 D1, D2, P, A, A/P, sn, gs, a, d : 1.04742E-06 -5.23711E-07 5.23711E-07 5.23546E-07 9.99685E-01 5.28766E-02 -1.04742E-06 9.99685E-01 5.28766E-02 f,g G 2.91655067 0.00000025 f,g F 2.91655067 0.00000025 D1, D2, P, A, A/P, sn, gs, a, d : 1.10368E-12 -5.51841E-13 5.51841E-13 5.47562E-13 9.92245E-01 3.32702E-05 -1.10368E-12 9.92305E-01 5.28766E-02 CONVERGENCE: FRTOL TEST SATISFIED value: 2.91655066630139 nfev, nfghev: 2 2 Final value: 2.916551 After optimisation: 1 1.00000E-04 1.71436E+01 9.99900E+03 4.34480E-08 2 0.00000E+00 4.49489E+00 9.99000E+02 -1.06626E-07 3 1.00000E-04 9.27305E-01 9.99000E+02 2.20861E-07 4 0.00000E+00 3.11955E+01 9.99000E+02 2.95845E-09 5 0.00000E+00 4.36981E+01 9.99000E+02 -7.71136E-10 6 -9.99000E+02 -1.77215E+01 9.99000E+02 -3.31831E-09 7 -9.99000E+02 5.02497E+00 9.99000E+02 -6.81966E-10 nvar, nfree, nbind: 7 7 0 Final model : 2.916551 6.99E-13 3 1 Laue 17.14360 1 0.00010 9999.00000 1 1 K_over T 17.13823 0.04500 4.49489 1 0.00000 999.00000 2 2 B_frag_imp T 4.49748 0.09122 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 0.92731 1 0.00010 999.00000 6 3 K_solv T 0.92725 0.01620 31.19548 1 0.00000 999.00000 7 4 B_solv T 31.19634 2.89043 1.0 -1 1.0 1.0 0 K_solv_imp F 43.69806 1 0.00000 999.00000 8 5 B_solv_imp T 43.64583 2.00708 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.72152 1 -999.00000 999.00000 10 6 B11_over T -17.71652 0.22727 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.02497 1 -999.00000 999.00000 12 7 B22_over T 5.02277 0.22001 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 12.69655 -1 -999.00000 999.00000 15 B33_over F 12.69374 0.00000