Details of GSAS fit for ZnO 674b data jun/11bmb_4715 # Run no. = 4715 # No. steps = 34500 # Scan time = MAY 31, 2014 23:52 # Sample name = NIST SRM 674b (ZnO) # Composition = Zinc Oxide # Sample Comment = 0.8 mm dia Kapton # Temp (K) = 295.0 # 2theta step (deg) = 0.001 # Time per step (sec) = 0.1 # 100/Ring Current[0] = 1.025 # Monitor I0 [0] = 89933.5 # Monitor I1 [0] = 73484.6 # Gonio._radius [mm] = 1000.0 # Calibration file = 11bmb_4699_2thcorr.calib # 2Theta correction subtracted # Calibrated wavelength = 0.413671 # Normalization factor = 8.1812 GSAS Fit Summary of 11-BM ZnO 674b Data # by Matthew Suchomel at APS/ANL, 2014 Using GSAS/EXPGUI ************************************** lattice a = 3.24999 (refined) SRM lattice a = 3.24989 A Delta lattice a from SRM = 0.0001 A lattice c = 5.20684 (refined) SRM lattice c = 5.20653 A Delta lattice c from SRM = 0.0003 A Lambda = 0.413671 A (FIXED) Zn X,Y,Z = 0.333300 0.666700 0.000881 (refined) Zn Uiso = 0.005 O X,Y, Z, = 0.333300 0.666700 0.381619 (refined) O Uiso = 0.004 background = 6-term Shifted Chebyschev (type #1) GSAS Profile type 4 GU = 1.35 (refined) GV = -0.36 (refined) GW = 0.092 (refined) LX = 0.86 (refined; gives ~ 275 nm particle, vs SRN value of 201 nm) S1 = 3.252E-02 (refined) S2 = 0 (refined) S3 = 1.552E-02 (refined) SH/L = 0.0011 (FIXED) 2th zero (deg) = 0.00013 (refined) Absorption (mR/L) = 0.0 (FIXED) Rwp % = 8.4% chi**2 = 1.56