NH4(VO2)(HPO4) Amoros P, Beltran-Porter D, Le Bail A, Ferey G, Villeneuve G European Journal of Solid State and Inorganic Chemistry 25 (1988) 599-607 Crystal structure of A(VO2)(HPO4)(A=NH4,K,Rb) solved from X-ray powder diffraction _cod_database_code 1000080 _database_code_amcsd 0012524 CELL PARAMETERS: 6.8064 9.2567 17.7320 90.000 90.000 90.000 SPACE GROUP: Pbca X-RAY WAVELENGTH: 1.541838 Cell Volume: 1117.201 Density (g/cm3): 2.282 MAX. ABS. INTENSITY / VOLUME**2: 13.29046812 RIR: 1.897 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 9.98 100.00 8.8660 0 0 2 2 16.42 40.79 5.3989 1 0 2 4 16.92 3.84 5.2388 1 1 1 8 19.03 3.60 4.6637 1 1 2 8 19.18 35.99 4.6283 0 2 0 2 19.83 51.16 4.4783 0 2 1 4 20.03 3.83 4.4330 0 0 4 2 21.66 35.34 4.1029 0 2 2 4 23.78 19.91 3.7412 1 2 1 8 23.96 11.75 3.7146 1 0 4 4 25.35 5.48 3.5139 1 2 2 8 25.84 3.17 3.4474 1 1 4 8 27.77 3.98 3.2126 1 2 3 8 27.87 12.25 3.2014 0 2 4 4 27.93 4.83 3.1942 2 1 0 4 28.09 44.61 3.1772 2 0 2 4 29.73 2.57 3.0051 2 1 2 8 30.01 9.62 2.9779 1 1 5 8 30.24 21.52 2.9553 0 0 6 2 30.87 1.63 2.8970 1 2 4 8 31.85 4.90 2.8101 2 1 3 8 32.66 6.76 2.7418 2 2 0 4 33.19 10.49 2.6995 2 0 4 4 34.23 19.31 2.6194 2 2 2 8 34.48 16.63 2.6013 1 2 5 8 36.06 1.00 2.4909 0 2 6 4 38.61 1.36 2.3318 2 2 4 8 39.17 4.59 2.2996 1 1 7 8 39.26 16.61 2.2947 0 4 1 4 40.60 2.90 2.2221 0 2 7 4 40.71 3.92 2.2165 0 0 8 2 41.07 1.05 2.1980 3 0 2 4 41.63 3.99 2.1693 2 1 6 8 44.15 2.40 2.0515 0 4 4 4 44.49 1.50 2.0365 1 3 6 8 45.11 3.06 2.0100 2 2 6 8 45.37 4.83 1.9991 0 2 8 4 45.99 2.42 1.9732 3 1 4 8 47.81 2.41 1.9026 2 4 1 8 48.37 1.01 1.8816 1 3 7 8 48.68 1.82 1.8706 2 4 2 8 49.05 3.06 1.8573 2 0 8 4 49.14 2.34 1.8542 1 1 9 8 49.22 2.82 1.8511 3 2 4 8 50.10 4.66 1.8206 2 4 3 8 51.54 1.57 1.7732 0 0 10 2 51.75 1.17 1.7665 3 2 5 8 51.95 4.62 1.7601 1 4 6 8 53.13 2.90 1.7237 2 2 8 8 53.64 4.10 1.7085 0 4 7 4 53.88 2.06 1.7016 4 0 0 2 54.74 1.03 1.6769 2 1 9 8 54.86 1.21 1.6736 4 1 0 4 54.95 2.30 1.6711 4 0 2 4 55.12 4.75 1.6662 4 1 1 8 55.25 2.42 1.6626 3 1 7 8 55.50 1.83 1.6558 0 2 10 4 57.36 1.22 1.6063 2 4 6 8 57.61 1.04 1.6000 2 2 9 8 57.72 2.79 1.5971 4 2 0 4 58.06 1.96 1.5886 4 0 4 4 58.71 4.04 1.5725 2 0 10 4 59.80 2.24 1.5466 1 1 11 8 61.24 1.64 1.5135 4 1 5 8 61.74 1.76 1.5025 4 2 4 8 62.19 3.86 1.4928 0 6 3 4 62.31 1.16 1.4900 4 3 0 4 62.36 1.28 1.4889 2 2 10 8 62.52 1.29 1.4856 1 2 11 8 63.04 1.12 1.4746 4 0 6 4 63.32 2.13 1.4688 3 1 9 8 66.28 1.29 1.4102 3 3 8 8 66.42 1.06 1.4075 0 4 10 4 66.77 1.59 1.4011 2 3 10 8 66.78 5.73 1.4007 2 6 1 8 67.02 1.87 1.3963 4 1 7 8 67.32 1.33 1.3909 1 5 8 8 68.33 2.76 1.3727 2 4 9 8 68.67 1.65 1.3668 4 4 1 8 71.24 1.05 1.3237 1 1 13 8 72.33 1.85 1.3063 2 6 5 8 72.69 1.47 1.3008 2 2 12 8 75.51 1.05 1.2591 5 1 5 8 77.41 1.27 1.2329 2 4 11 8 77.72 1.85 1.2288 2 6 7 8 81.03 1.44 1.1867 4 2 10 8 85.05 1.18 1.1406 4 6 1 8 89.67 1.47 1.0934 2 8 1 8 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.