******************************** UPPW 08 * Starting Powder Indexing Mode= Full powder indexing * Phase 1 Minimizer = 0.000000 symmetry= orthorhombic Chi2/df = 8.93 Dif(A) = 0.00604 Phase No 1 Vol= 1190.65 A = 4.7582 +- 0.0021 B = 14.9908 +- 0.0041 C = 16.6922 +- 0.0044 alpha = 90.00 +- 0.00 beta = 90.00 +- 0.00 gamma = 90.00 +- 0.00 Powder Indexing N h k l phase d_exp d_fit Dif. chi2 1 0 1 1 11.15800 11.15325 -0.00475 2.9 2 0 0 2 8.34050 8.34608 0.00558 11.8 3 0 2 0 7.49600 7.49540 -0.00060 0.3 4 0 1 2 7.28620 7.29210 0.00590 34.8 5 0 2 1 6.84100 6.83768 -0.00332 1.3 6 0 2 2 5.57410 5.57663 0.00253 0.6 7 0 1 3 5.20910 5.21634 0.00724 5.8 8 1 1 0 4.53460 4.53525 0.00065 0.0 9 0 2 3 4.46190 4.46764 0.00574 3.6 10 1 0 2 4.13650 4.13364 -0.00286 0.8 11 1 2 0 4.00270 4.01714 0.01444 52.1 12 1 2 1 3.90680 3.90563 -0.00117 0.2 13 0 4 0 3.73830 3.74770 0.00940 8.8 14 1 2 2 3.62710 3.61968 -0.00742 25.9 15 1 1 3 3.51500 3.51540 0.00040 0.0 16 1 3 1 3.38780 3.37472 -0.01308 5.1 17 0 0 5 3.37060 3.33843 -0.03217 41.4 18 1 2 3 3.25740 3.25699 -0.00041 0.0 19 1 3 2 3.18710 3.18508 -0.00202 0.3 20 0 4 3 3.10910 3.10836 -0.00074 0.0 21 1 1 4 3.06430 3.07086 0.00656 1.3 Average d - d_calc (A) = 0.00605 Max d - d_calc (A) = 0.03217 Average exp_error (A) = 0.00335 N(d-visible) / N(d_exp) = 37 / 21 Phase 1 real hkl range: ( 0, 1), ( 0, 4), ( 0, 5) ************************************************************************