Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 16.61045 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 14.97104 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 0.96818 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 27.35780 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 26.03341 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 -17.58723 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 5.36554 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 12.22169 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 16.61045 14.97104 0.96818 27.35780 26.03341 -17.58723 5.36554 value: 3.19445584868562 0.125000000000000 2.472698962345416E-004 f,g S 3.19445585 0.00024727 f,g F 3.19445393 0.00024727 D1, D2, P, A, A/P, sn, gs, a, d : 3.85244E-06 -1.92622E-06 1.92622E-06 1.91988E-06 9.96710E-01 6.61349E-02 -3.85244E-06 9.96721E-01 6.61349E-02 f,g G 3.19445393 0.00000110 f,g F 3.19445393 0.00000110 D1, D2, P, A, A/P, sn, gs, a, d : 1.28702E-10 -6.43509E-11 6.43509E-11 6.43459E-11 9.99922E-01 5.97537E-04 -1.28702E-10 9.99922E-01 6.61349E-02 CONVERGENCE: FRTOL TEST SATISFIED value: 3.19445392873845 nfev, nfghev: 2 2 Final value: 3.194454 After optimisation: 1 1.00000E-04 1.66179E+01 9.99900E+03 3.33836E-07 2 0.00000E+00 1.49245E+01 9.99000E+02 -3.56089E-07 3 1.00000E-04 9.68199E-01 9.99000E+02 9.87509E-07 4 0.00000E+00 2.73473E+01 9.99000E+02 1.25581E-08 5 0.00000E+00 2.60742E+01 9.99000E+02 -8.68132E-09 6 -9.99000E+02 -1.75723E+01 9.99000E+02 1.72370E-08 7 -9.99000E+02 5.35617E+00 9.99000E+02 -2.93564E-09 nvar, nfree, nbind: 7 7 0 Final model : 3.194454 5.47E-11 3 1 Laue 16.61794 1 0.00010 9999.00000 1 1 K_over T 16.61045 0.06591 14.92446 1 0.00000 999.00000 2 2 B_frag_imp T 14.97104 0.27718 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 0.96820 1 0.00010 999.00000 6 3 K_solv T 0.96818 0.01828 27.34731 1 0.00000 999.00000 7 4 B_solv T 27.35780 3.85512 1.0 -1 1.0 1.0 0 K_solv_imp F 26.07419 1 0.00000 999.00000 8 5 B_solv_imp T 26.03341 2.98141 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.57231 1 -999.00000 999.00000 10 6 B11_over T -17.58723 0.31895 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.35617 1 -999.00000 999.00000 12 7 B22_over T 5.36554 0.31063 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 12.21614 -1 -999.00000 999.00000 15 B33_over F 12.22169 0.00000