Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 17.87157 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 2 22.98154 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 0.97787 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 0.0 7 25.54832 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 0.0 8 10.77573 0.00000 0.0 0.0 0.0 0.0 1.0 0.0 0.0 0.0 9 -9.90201 0.00000 0.0 0.0 0.0 0.0 0.0 1.0 0.0 0.0 10 -18.33847 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 5.96420 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 12.37427 0.00000 0.0 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 17.87157 22.98154 0.97787 25.54832 10.77573 -9.90201 -18.33847 5.96420 value: 3.27384851009656 0.125000000000000 4.203080419108901E-004 f,g S 3.27384851 0.00042031 f,g F 3.27376207 0.00042031 D1, D2, P, A, A/P, sn, gs, a, d : 1.66108E-04 -8.30539E-05 8.30539E-05 8.64433E-05 1.04081E+00 1.32892E+00 -1.66108E-04 1.04255E+00 1.25000E-01 f,g G 3.27376207 0.00004733 f,g F 3.27376170 0.00004733 D1, D2, P, A, A/P, sn, gs, a, d : 7.23741E-07 -3.61870E-07 3.61870E-07 3.63078E-07 1.00334E+00 1.42896E-01 -7.23741E-07 1.00335E+00 5.00000E-01 f,g G 3.27376170 0.00000050 f,g F 3.27376170 0.00000050 D1, D2, P, A, A/P, sn, gs, a, d : 1.97284E-11 -9.86420E-12 9.86420E-12 9.87033E-12 1.00062E+00 1.30663E-03 -1.97284E-11 1.00062E+00 5.00000E-01 CONVERGENCE: FRTOL TEST SATISFIED value: 3.27376170374099 nfev, nfghev: 3 3 Final value: 3.273762 After optimisation: 1 1.00000E-04 1.79917E+01 9.99900E+03 4.83898E-08 2 0.00000E+00 2.36287E+01 9.99000E+02 -6.67228E-08 3 1.00000E-04 9.84429E-01 9.99000E+02 -4.89279E-07 4 0.00000E+00 2.50396E+01 9.99000E+02 -2.81848E-09 5 0.00000E+00 1.19575E+01 9.99000E+02 -9.48014E-09 6 -9.99000E+02 -9.63894E+00 9.99000E+02 -5.38485E-09 7 -9.99000E+02 -1.83037E+01 9.99000E+02 9.41067E-11 8 -9.99000E+02 5.97972E+00 9.99000E+02 5.61756E-11 nvar, nfree, nbind: 8 8 0 Final model : 3.273762 3.22E-11 3 1 Laue 17.99170 1 0.00010 9999.00000 1 1 K_over T 17.87157 0.19223 23.62869 1 0.00000 999.00000 2 2 B_frag_imp T 22.98154 0.44994 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 0.98443 1 0.00010 999.00000 6 3 K_solv T 0.97787 0.02021 25.03964 1 0.00000 999.00000 7 4 B_solv T 25.54832 5.19756 1.0 -1 1.0 1.0 0 K_solv_imp F 11.95755 1 0.00000 999.00000 8 5 B_solv_imp T 10.77573 4.58591 -9.63894 1 -999.00000 999.00000 9 6 B_over T -9.90201 0.44887 -18.30365 1 -999.00000 999.00000 10 7 B11_over T -18.33847 0.34244 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.97972 1 -999.00000 999.00000 12 8 B22_over T 5.96420 0.33504 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 12.32394 -1 -999.00000 999.00000 15 B33_over F 12.37427 0.00000