Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 16.78237 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 4.08126 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 0.91718 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 30.83098 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 42.80481 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 -17.78284 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 5.03999 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 12.74285 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 16.78237 4.08126 0.91718 30.83098 42.80481 -17.78284 5.03999 value: 2.91127379047167 0.125000000000000 4.550090787176669E-004 f,g S 2.91127379 0.00045501 f,g F 2.91127101 0.00045501 D1, D2, P, A, A/P, sn, gs, a, d : 5.56476E-06 -2.78238E-06 2.78238E-06 2.78472E-06 1.00084E+00 5.89461E-02 -5.56476E-06 1.00084E+00 5.89461E-02 f,g G 2.91127101 0.00000064 f,g F 2.91127101 0.00000064 D1, D2, P, A, A/P, sn, gs, a, d : 2.90993E-11 -1.45497E-11 1.45497E-11 1.45430E-11 9.99544E-01 8.52111E-04 -2.90993E-11 9.99544E-01 5.89958E-02 CONVERGENCE: FRTOL TEST SATISFIED value: 2.91127100573510 nfev, nfghev: 2 2 Final value: 2.911271 After optimisation: 1 1.00000E-04 1.67949E+01 9.99900E+03 -3.60830E-07 2 0.00000E+00 4.08643E+00 9.99000E+02 -4.50036E-07 3 1.00000E-04 9.17453E-01 9.99000E+02 2.80636E-07 4 0.00000E+00 3.08681E+01 9.99000E+02 -5.42769E-10 5 0.00000E+00 4.28490E+01 9.99000E+02 -5.63492E-09 6 -9.99000E+02 -1.77840E+01 9.99000E+02 -4.46321E-10 7 -9.99000E+02 5.03986E+00 9.99000E+02 -6.47314E-10 nvar, nfree, nbind: 7 7 0 Final model : 2.911271 9.80E-12 3 1 Laue 16.79494 1 0.00010 9999.00000 1 1 K_over T 16.78237 0.04395 4.08643 1 0.00000 999.00000 2 2 B_frag_imp T 4.08126 0.08689 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 0.91745 1 0.00010 999.00000 6 3 K_solv T 0.91718 0.01584 30.86813 1 0.00000 999.00000 7 4 B_solv T 30.83098 2.85355 1.0 -1 1.0 1.0 0 K_solv_imp F 42.84898 1 0.00000 999.00000 8 5 B_solv_imp T 42.80481 1.94147 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.78397 1 -999.00000 999.00000 10 6 B11_over T -17.78284 0.22515 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.03986 1 -999.00000 999.00000 12 7 B22_over T 5.03999 0.21791 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 12.74411 -1 -999.00000 999.00000 15 B33_over F 12.74285 0.00000