Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 16.60131 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 15.08638 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 0.96832 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 27.40696 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 25.97572 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 -17.61300 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 5.38173 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 12.23127 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 16.60131 15.08638 0.96832 27.40696 25.97572 -17.61300 5.38173 value: 3.21925540371746 0.125000000000000 1.026253333276657E-002 f,g S 3.21925540 0.01026253 f,g F 3.21337704 0.01026253 D1, D2, P, A, A/P, sn, gs, a, d : 1.04946E-02 -5.24732E-03 5.24732E-03 5.87836E-03 1.12026E+00 8.25927E+00 -1.04946E-02 1.13670E+00 1.25000E-01 f,g G 3.21337704 0.00087805 f,g F 3.21305478 0.00087805 D1, D2, P, A, A/P, sn, gs, a, d : 6.13422E-04 -3.06711E-04 3.06711E-04 3.22261E-04 1.05070E+00 6.26429E+00 -6.13422E-04 1.05341E+00 5.00000E-01 f,g G 3.21305478 0.00007915 f,g F 3.21305260 0.00007915 D1, D2, P, A, A/P, sn, gs, a, d : 4.33413E-06 -2.16707E-06 2.16707E-06 2.17857E-06 1.00531E+00 2.32016E-01 -4.33413E-06 1.00534E+00 2.00000E+00 f,g G 3.21305260 0.00000087 f,g F 3.21305260 0.00000087 D1, D2, P, A, A/P, sn, gs, a, d : 2.93662E-10 -1.46831E-10 1.46831E-10 1.46846E-10 1.00010E+00 1.81295E-03 -2.93662E-10 1.00010E+00 2.00000E+00 CONVERGENCE: FRTOL TEST SATISFIED value: 3.21305259996784 nfev, nfghev: 4 4 Final value: 3.213053 After optimisation: 1 1.00000E-04 1.70309E+01 9.99900E+03 -3.12922E-08 2 0.00000E+00 1.86836E+01 9.99000E+02 -4.37291E-07 3 1.00000E-04 1.03941E+00 9.99000E+02 7.47871E-07 4 0.00000E+00 3.79325E+01 9.99000E+02 6.05583E-09 5 0.00000E+00 1.64203E+01 9.99000E+02 -6.52079E-09 6 -9.99000E+02 -1.76812E+01 9.99000E+02 -1.79005E-09 7 -9.99000E+02 5.67097E+00 9.99000E+02 -2.99559E-10 nvar, nfree, nbind: 7 7 0 Final model : 3.213053 8.29E-11 3 1 Laue 17.03090 1 0.00010 9999.00000 1 1 K_over T 16.60131 0.06236 18.68360 1 0.00000 999.00000 2 2 B_frag_imp T 15.08638 0.30398 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 1.03941 1 0.00010 999.00000 6 3 K_solv T 0.96832 0.01955 37.93252 1 0.00000 999.00000 7 4 B_solv T 27.40696 4.48663 1.0 -1 1.0 1.0 0 K_solv_imp F 16.42026 1 0.00000 999.00000 8 5 B_solv_imp T 25.97572 3.37115 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.68119 1 -999.00000 999.00000 10 6 B11_over T -17.61300 0.32668 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.67097 1 -999.00000 999.00000 12 7 B22_over T 5.38173 0.31859 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 12.01022 -1 -999.00000 999.00000 15 B33_over F 12.23127 0.00000