Details of MaxLik refinement
Calling alabaster 1 9 11 Calling optimiser: i var_all var_fixed constraint 1 17.26064 0.00000 1.0 0.0 0.0 0.0 0.0 0.0 0.0 2 4.06194 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 0.92183 0.00000 0.0 0.0 1.0 0.0 0.0 0.0 0.0 7 30.86582 0.00000 0.0 0.0 0.0 1.0 0.0 0.0 0.0 8 45.21923 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 -17.88372 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 5.01402 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 12.86970 0.00000 0.0 0.0 0.0 0.0 0.0 -1.0 -1.0 var_free: 17.26064 4.06194 0.92183 30.86582 45.21923 -17.88372 5.01402 value: 2.89386040199267 0.125000000000000 2.036086898844613E-004 f,g S 2.89386040 0.00020361 f,g F 2.89385973 0.00020361 D1, D2, P, A, A/P, sn, gs, a, d : 1.35328E-06 -6.76639E-07 6.76639E-07 6.76143E-07 9.99267E-01 2.28488E-02 -1.35328E-06 9.99267E-01 2.28488E-02 f,g G 2.89385973 0.00000030 f,g F 2.89385973 0.00000030 D1, D2, P, A, A/P, sn, gs, a, d : 2.89006E-12 -1.44503E-12 1.44503E-12 1.43796E-12 9.95107E-01 4.23484E-05 -2.89006E-12 9.95131E-01 2.28488E-02 CONVERGENCE: FRTOL TEST SATISFIED value: 2.89385972584824 nfev, nfghev: 2 2 Final value: 2.893860 After optimisation: 1 1.00000E-04 1.72545E+01 9.99900E+03 -1.39438E-07 2 0.00000E+00 4.05785E+00 9.99000E+02 -1.55018E-07 3 1.00000E-04 9.21728E-01 9.99000E+02 2.13345E-07 4 0.00000E+00 3.08613E+01 9.99000E+02 1.94799E-09 5 0.00000E+00 4.51982E+01 9.99000E+02 -1.36653E-09 6 -9.99000E+02 -1.78843E+01 9.99000E+02 -5.69288E-10 7 -9.99000E+02 5.01492E+00 9.99000E+02 3.27100E-10 nvar, nfree, nbind: 7 7 0 Final model : 2.893860 1.61E-12 3 1 Laue 17.25452 1 0.00010 9999.00000 1 1 K_over T 17.26064 0.04409 4.05785 1 0.00000 999.00000 2 2 B_frag_imp T 4.06194 0.08495 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 0.92173 1 0.00010 999.00000 6 3 K_solv T 0.92183 0.01598 30.86129 1 0.00000 999.00000 7 4 B_solv T 30.86582 2.82465 1.0 -1 1.0 1.0 0 K_solv_imp F 45.19815 1 0.00000 999.00000 8 5 B_solv_imp T 45.21923 1.99076 0.00000 -1 -999.00000 999.00000 9 B_over F 0.00000 0.00000 -17.88432 1 -999.00000 999.00000 10 6 B11_over T -17.88372 0.22061 0.00000 -1 -999.00000 999.00000 11 B12_over F 0.00000 0.00000 5.01492 1 -999.00000 999.00000 12 7 B22_over T 5.01402 0.21349 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 12.86940 -1 -999.00000 999.00000 15 B33_over F 12.86970 0.00000