Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 16.41050 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 8.88104 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 0.94761 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 27.18061 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 35.99566 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 -17.39449 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 4.89220 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 12.50229 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 16.41050 8.88104 0.94761 27.18061 35.99566 -17.39449 4.89220 value: 3.08375712757165 0.125000000000000 3.505933831470554E-004 f,g S 3.08375713 0.00035059 f,g F 3.08375555 0.00035059 D1, D2, P, A, A/P, sn, gs, a, d : 3.16390E-06 -1.58195E-06 1.58195E-06 1.58105E-06 9.99431E-01 7.57449E-02 -3.16390E-06 9.99431E-01 7.57449E-02 f,g G 3.08375555 0.00000028 f,g F 3.08375555 0.00000028 D1, D2, P, A, A/P, sn, gs, a, d : 3.75190E-11 -1.87595E-11 1.87595E-11 1.87619E-11 1.00013E+00 2.55249E-03 -3.75190E-11 1.00013E+00 7.57449E-02 CONVERGENCE: FRTOL TEST SATISFIED value: 3.08375554650295 nfev, nfghev: 2 2 Final value: 3.083756 After optimisation: 1 1.00000E-04 1.64197E+01 9.99900E+03 1.41598E-07 2 0.00000E+00 8.87165E+00 9.99000E+02 -1.90511E-07 3 1.00000E-04 9.47721E-01 9.99000E+02 -1.42492E-07 4 0.00000E+00 2.72574E+01 9.99000E+02 -5.38927E-09 5 0.00000E+00 3.59964E+01 9.99000E+02 -3.11149E-09 6 -9.99000E+02 -1.73935E+01 9.99000E+02 5.30538E-09 7 -9.99000E+02 4.89212E+00 9.99000E+02 3.36540E-10 nvar, nfree, nbind: 7 7 0 Final model : 3.083756 3.19E-11 3 1 Laue 16.41971 1 0.00010 9999.00000 1 1 K_over T 16.41050 0.05654 8.87165 1 0.00000 999.00000 2 2 B_frag_imp T 8.88104 0.17048 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 0.94772 1 0.00010 999.00000 6 3 K_solv T 0.94761 0.01715 27.25736 1 0.00000 999.00000 7 4 B_solv T 27.18061 3.23920 1.0 -1 1.0 1.0 0 K_solv_imp F 35.99636 1 0.00000 999.00000 8 5 B_solv_imp T 35.99566 2.39479 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.39346 1 -999.00000 999.00000 10 6 B11_over T -17.39449 0.28185 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 4.89212 1 -999.00000 999.00000 12 7 B22_over T 4.89220 0.27361 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 12.50133 -1 -999.00000 999.00000 15 B33_over F 12.50229 0.00000