Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 17.23299 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 4.15566 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 0.92071 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 30.93688 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 45.76095 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 -17.85833 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 5.05497 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 12.80336 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 17.23299 4.15566 0.92071 30.93688 45.76095 -17.85833 5.05497 value: 2.89938755319250 0.125000000000000 5.023736083866400E-005 f,g S 2.89938755 0.00005024 f,g F 2.89938750 0.00005024 D1, D2, P, A, A/P, sn, gs, a, d : 1.15280E-07 -5.76402E-08 5.76402E-08 5.76137E-08 9.99540E-01 1.71394E-02 -1.15280E-07 9.99540E-01 1.71394E-02 f,g G 2.89938750 0.00000004 f,g F 2.89938750 0.00000004 D1, D2, P, A, A/P, sn, gs, a, d : 7.09420E-14 -3.54710E-14 3.54710E-14 3.95239E-14 1.11426E+00 5.06137E-06 -7.09420E-14 1.12900E+00 1.71394E-02 CONVERGENCE: FRTOL TEST SATISFIED value: 2.89938749557877 nfev, nfghev: 2 2 Final value: 2.899387 After optimisation: 1 1.00000E-04 1.72317E+01 9.99900E+03 -1.43121E-08 2 0.00000E+00 4.15302E+00 9.99000E+02 -2.59899E-08 3 1.00000E-04 9.20678E-01 9.99000E+02 2.49195E-08 4 0.00000E+00 3.09230E+01 9.99000E+02 4.08751E-10 5 0.00000E+00 4.57704E+01 9.99000E+02 -1.77794E-10 6 -9.99000E+02 -1.78596E+01 9.99000E+02 -2.61944E-10 7 -9.99000E+02 5.05681E+00 9.99000E+02 3.92947E-10 nvar, nfree, nbind: 7 7 0 Final model : 2.899387 4.42E-14 3 1 Laue 17.23173 1 0.00010 9999.00000 1 1 K_over T 17.23299 0.04448 4.15302 1 0.00000 999.00000 2 2 B_frag_imp T 4.15566 0.08721 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 0.92068 1 0.00010 999.00000 6 3 K_solv T 0.92071 0.01610 30.92305 1 0.00000 999.00000 7 4 B_solv T 30.93688 2.86158 1.0 -1 1.0 1.0 0 K_solv_imp F 45.77039 1 0.00000 999.00000 8 5 B_solv_imp T 45.76095 2.02360 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.85959 1 -999.00000 999.00000 10 6 B11_over T -17.85833 0.22192 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.05681 1 -999.00000 999.00000 12 7 B22_over T 5.05497 0.21480 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 12.80278 -1 -999.00000 999.00000 15 B33_over F 12.80336 0.00000