Details of MaxLik refinement
Calling alabaster 1 8 9 Calling optimiser: i var_all var_fixed constraint 1 16.60985 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 2 2.56352 0.00000 0.0 1.0 0.0 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 0.0 4 0.00000 0.00000 0.0 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 0.0 6 0.89847 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 0.0 7 32.15425 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 0.0 8 27.71875 0.00000 0.0 0.0 0.0 0.0 1.0 0.0 0.0 0.0 9 0.00000 0.00000 0.0 0.0 0.0 0.0 0.0 1.0 0.0 0.0 10 -17.94608 0.00000 0.0 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 0.0 12 4.99888 0.00000 0.0 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 0.0 14 0.00000 0.00000 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 15 12.94720 0.00000 0.0 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 16.60985 2.56352 0.89847 32.15425 27.71875 0.00000 -17.94608 4.99888 value: 2.76836274449545 0.125000000000000 1.097963589640374E-002 f,g S 2.76836274 0.01097964 f,g F 2.76810857 0.01097964 D1, D2, P, A, A/P, sn, gs, a, d : 5.68474E-04 -2.84237E-04 2.84237E-04 2.54173E-04 8.94227E-01 3.43403E+00 -5.68474E-04 9.04345E-01 1.25000E-01 f,g G 2.76810857 0.00136341 f,g F 2.76810150 0.00136341 D1, D2, P, A, A/P, sn, gs, a, d : 1.38702E-05 -6.93511E-06 6.93511E-06 7.07590E-06 1.02030E+00 6.97340E-01 -1.38702E-05 1.02072E+00 5.00000E-01 f,g G 2.76810150 0.00003036 f,g F 2.76810149 0.00003036 D1, D2, P, A, A/P, sn, gs, a, d : 1.39966E-08 -6.99831E-09 6.99831E-09 7.00337E-09 1.00072E+00 2.58428E-02 -1.39966E-08 1.00072E+00 7.11791E-01 f,g G 2.76810149 0.00000003 f,g F 2.76810149 0.00000003 D1, D2, P, A, A/P, sn, gs, a, d : 1.65949E-14 -8.29745E-15 8.29745E-15 6.66134E-15 8.02818E-01 2.97053E-05 -1.65949E-14 8.35295E-01 7.11791E-01 CONVERGENCE: FRTOL TEST SATISFIED value: 2.76810148887886 nfev, nfghev: 4 4 Final value: 2.768101 After optimisation: 1 1.00000E-04 1.66304E+01 9.99900E+03 4.65741E-10 2 0.00000E+00 2.55995E+00 9.99000E+02 -8.02932E-10 3 1.00000E-04 8.78483E-01 9.99000E+02 -2.82940E-08 4 0.00000E+00 3.36315E+01 9.99000E+02 -1.09121E-10 5 0.00000E+00 2.54425E+01 9.99000E+02 -7.94228E-10 6 -9.99000E+02 2.15082E-02 9.99000E+02 6.41695E-10 7 -9.99000E+02 -1.79564E+01 9.99000E+02 -3.15452E-11 8 -9.99000E+02 5.00629E+00 9.99000E+02 -1.60488E-12 nvar, nfree, nbind: 8 8 0 Final model : 2.768101 3.16E-14 3 1 Laue 16.63041 1 0.00010 9999.00000 1 1 K_over T 16.60985 0.09041 2.55995 1 0.00000 999.00000 2 2 B_frag_imp T 2.56352 0.05133 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 0.87848 1 0.00010 999.00000 6 3 K_solv T 0.89847 0.01208 33.63148 1 0.00000 999.00000 7 4 B_solv T 32.15425 2.00118 1.0 -1 1.0 1.0 0 K_solv_imp F 25.44251 1 0.00000 999.00000 8 5 B_solv_imp T 27.71875 1.22431 0.02151 1 -999.00000 999.00000 9 6 B_over T 0.00000 0.24406 -17.95636 1 -999.00000 999.00000 10 7 B11_over T -17.94608 0.19235 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.00629 1 -999.00000 999.00000 12 8 B22_over T 4.99888 0.18424 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 12.95007 -1 -999.00000 999.00000 15 B33_over F 12.94720 0.00000