Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 16.84222 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 3.62792 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 0.91589 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 31.69808 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 40.90894 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 -17.93152 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 5.00334 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 12.92818 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 16.84222 3.62792 0.91589 31.69808 40.90894 -17.93152 5.00334 value: 2.87927973236294 0.125000000000000 2.029778163894600E-004 f,g S 2.87927973 0.00020298 f,g F 2.87927919 0.00020298 D1, D2, P, A, A/P, sn, gs, a, d : 1.08431E-06 -5.42153E-07 5.42153E-07 5.42369E-07 1.00040E+00 2.93056E-02 -1.08431E-06 1.00040E+00 2.93056E-02 f,g G 2.87927919 0.00000019 f,g F 2.87927919 0.00000019 D1, D2, P, A, A/P, sn, gs, a, d : 1.06813E-12 -5.34064E-13 5.34064E-13 5.25802E-13 9.84529E-01 3.40935E-05 -1.06813E-12 9.84765E-01 2.93173E-02 CONVERGENCE: FRTOL TEST SATISFIED value: 2.87927918999363 nfev, nfghev: 2 2 Final value: 2.879279 After optimisation: 1 1.00000E-04 1.68477E+01 9.99900E+03 -7.94253E-08 2 0.00000E+00 3.62977E+00 9.99000E+02 -1.05486E-07 3 1.00000E-04 9.16072E-01 9.99000E+02 1.31044E-07 4 0.00000E+00 3.16946E+01 9.99000E+02 1.27063E-09 5 0.00000E+00 4.09375E+01 9.99000E+02 -1.24443E-09 6 -9.99000E+02 -1.79327E+01 9.99000E+02 -6.11761E-10 7 -9.99000E+02 5.00284E+00 9.99000E+02 -5.38879E-10 nvar, nfree, nbind: 7 7 0 Final model : 2.879279 6.33E-13 3 1 Laue 16.84772 1 0.00010 9999.00000 1 1 K_over T 16.84222 0.04164 3.62977 1 0.00000 999.00000 2 2 B_frag_imp T 3.62792 0.07658 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 0.91607 1 0.00010 999.00000 6 3 K_solv T 0.91589 0.01535 31.69456 1 0.00000 999.00000 7 4 B_solv T 31.69808 2.73069 1.0 -1 1.0 1.0 0 K_solv_imp F 40.93745 1 0.00000 999.00000 8 5 B_solv_imp T 40.90894 1.80719 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.93270 1 -999.00000 999.00000 10 6 B11_over T -17.93152 0.21673 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.00284 1 -999.00000 999.00000 12 7 B22_over T 5.00334 0.20946 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 12.92985 -1 -999.00000 999.00000 15 B33_over F 12.92818 0.00000