Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 17.14354 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 13.44718 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 0.97081 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 27.59056 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 30.13796 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 -17.14505 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 5.00474 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 12.14031 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 17.14354 13.44718 0.97081 27.59056 30.13796 -17.14505 5.00474 value: 3.15104028519356 0.125000000000000 7.797640683808615E-004 f,g S 3.15104029 0.00077976 f,g F 3.15102766 0.00077976 D1, D2, P, A, A/P, sn, gs, a, d : 2.53402E-05 -1.26701E-05 1.26701E-05 1.26297E-05 9.96811E-01 2.63461E-01 -2.53402E-05 9.96821E-01 1.25000E-01 f,g G 3.15102766 0.00000443 f,g F 3.15102765 0.00000443 D1, D2, P, A, A/P, sn, gs, a, d : 1.39871E-09 -6.99353E-10 6.99353E-10 6.99420E-10 1.00009E+00 3.15909E-03 -1.39871E-09 1.00009E+00 2.62624E-01 CONVERGENCE: FRTOL TEST SATISFIED value: 3.15102765481774 nfev, nfghev: 2 2 Final value: 3.151028 After optimisation: 1 1.00000E-04 1.71753E+01 9.99900E+03 1.15364E-06 2 0.00000E+00 1.33837E+01 9.99000E+02 -1.32666E-06 3 1.00000E-04 9.71219E-01 9.99000E+02 4.06948E-06 4 0.00000E+00 2.75951E+01 9.99000E+02 4.91034E-08 5 0.00000E+00 3.03880E+01 9.99000E+02 -1.38684E-08 6 -9.99000E+02 -1.71346E+01 9.99000E+02 4.91335E-08 7 -9.99000E+02 4.99505E+00 9.99000E+02 -2.26478E-08 nvar, nfree, nbind: 7 7 0 Final model : 3.151028 6.54E-10 3 1 Laue 17.17535 1 0.00010 9999.00000 1 1 K_over T 17.14354 0.06395 13.38374 1 0.00000 999.00000 2 2 B_frag_imp T 13.44718 0.23335 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 0.97122 1 0.00010 999.00000 6 3 K_solv T 0.97081 0.01847 27.59510 1 0.00000 999.00000 7 4 B_solv T 27.59056 3.57168 1.0 -1 1.0 1.0 0 K_solv_imp F 30.38803 1 0.00000 999.00000 8 5 B_solv_imp T 30.13796 2.83172 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.13464 1 -999.00000 999.00000 10 6 B11_over T -17.14505 0.30705 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 4.99505 1 -999.00000 999.00000 12 7 B22_over T 5.00474 0.29798 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 12.13959 -1 -999.00000 999.00000 15 B33_over F 12.14031 0.00000