Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 17.84988 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 3.31225 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 0.91590 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 27.35649 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 37.12827 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 -17.66871 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 4.83338 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 12.83533 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 17.84988 3.31225 0.91590 27.35649 37.12827 -17.66871 4.83338 value: 2.84615584518426 0.125000000000000 1.001593641871070E-003 f,g S 2.84615585 0.00100159 f,g F 2.84614045 0.00100159 D1, D2, P, A, A/P, sn, gs, a, d : 3.10839E-05 -1.55420E-05 1.55420E-05 1.53999E-05 9.90861E-01 9.45951E-02 -3.10839E-05 9.90944E-01 9.45951E-02 f,g G 2.84614045 0.00001600 f,g F 2.84614044 0.00001600 D1, D2, P, A, A/P, sn, gs, a, d : 6.76415E-09 -3.38208E-09 3.38208E-09 3.38272E-09 1.00019E+00 1.41600E-03 -6.76415E-09 1.00019E+00 9.45951E-02 f,g G 2.84614044 0.00000000 f,g F 2.84614044 0.00000000 D1, D2, P, A, A/P, sn, gs, a, d : 5.81400E-16 -2.90700E-16 2.90700E-16 8.88178E-15 3.05531E+01 2.41912E-07 -5.81400E-16 4.00000E+00 9.45951E-02 CONVERGENCE: FRTOL TEST SATISFIED value: 2.84614044188868 nfev, nfghev: 3 3 Final value: 2.846140 After optimisation: 1 1.00000E-04 1.78276E+01 9.99900E+03 -4.28207E-10 2 0.00000E+00 3.27992E+00 9.99000E+02 -3.21396E-09 3 1.00000E-04 9.15483E-01 9.99000E+02 3.58715E-09 4 0.00000E+00 2.73126E+01 9.99000E+02 5.22637E-11 5 0.00000E+00 3.70555E+01 9.99000E+02 -2.94919E-11 6 -9.99000E+02 -1.76724E+01 9.99000E+02 -9.42749E-12 7 -9.99000E+02 4.83444E+00 9.99000E+02 6.45185E-12 nvar, nfree, nbind: 7 7 0 Final model : 2.846140 4.76E-16 3 1 Laue 17.82758 1 0.00010 9999.00000 1 1 K_over T 17.84988 0.04245 3.27992 1 0.00000 999.00000 2 2 B_frag_imp T 3.31225 0.06810 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 0.91548 1 0.00010 999.00000 6 3 K_solv T 0.91590 0.01415 27.31261 1 0.00000 999.00000 7 4 B_solv T 27.35649 2.33789 1.0 -1 1.0 1.0 0 K_solv_imp F 37.05555 1 0.00000 999.00000 8 5 B_solv_imp T 37.12827 1.60035 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.67243 1 -999.00000 999.00000 10 6 B11_over T -17.66871 0.21124 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 4.83444 1 -999.00000 999.00000 12 7 B22_over T 4.83338 0.20318 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 12.83799 -1 -999.00000 999.00000 15 B33_over F 12.83533 0.00000