K2V2O2(O2)4(H2O).3H2O Lapshin A E, Smolin Y I, Shepelev Y F, Schwendt P, Gyepesova D Acta Crystallographica C46 (1990) 738-741 Structure of dipotassium aquadioxotetraperoxodivanadate(V) trihydrate Sample: T = 153 K _database_code_amcsd 0010129 CELL PARAMETERS: 6.5010 7.8820 7.5010 107.180 95.500 116.200 SPACE GROUP: P1 X-RAY WAVELENGTH: 1.541838 Cell Volume: 317.797 Density (g/cm3): 2.153 MAX. ABS. INTENSITY / VOLUME**2: 7.739219379 RIR: 1.170 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 12.81 100.00 6.9122 0 0 1 1 13.52 55.66 6.5472 0 1 0 1 14.70 25.91 6.0249 0 -1 1 1 14.85 46.94 5.9659 -1 1 0 1 15.75 37.91 5.6262 1 0 0 1 17.50 1.98 5.0671 -1 0 1 1 19.01 5.96 4.6681 1 -1 1 1 20.28 37.18 4.3785 -1 1 1 1 21.95 19.20 4.0499 0 1 1 1 22.86 43.69 3.8897 1 0 1 1 23.75 13.34 3.7461 -1 2 0 1 23.93 19.06 3.7179 1 -2 1 1 23.94 13.39 3.7167 -1 -1 1 1 24.15 5.40 3.6853 0 -1 2 1 25.32 30.34 3.5174 0 -2 1 1 25.47 9.02 3.4976 1 1 0 1 25.78 8.36 3.4561 0 0 2 1 26.47 5.01 3.3679 -1 0 2 1 27.24 16.98 3.2736 0 2 0 1 27.65 18.69 3.2267 -2 1 0 1 28.92 23.40 3.0876 -1 -1 2 1 29.01 1.93 3.0781 1 -1 2 1 29.15 13.13 3.0637 -2 1 1 1 29.66 1.89 3.0124 0 -2 2 1 29.91 6.00 2.9876 -1 2 1 1 29.96 2.88 2.9829 -2 2 0 1 30.35 14.84 2.9451 1 -2 2 1 30.72 19.62 2.9100 -1 1 2 1 31.00 4.53 2.8850 -2 0 1 1 31.81 6.16 2.8131 2 0 0 1 31.90 4.57 2.8056 2 -2 1 1 31.95 1.87 2.8015 2 -1 1 1 33.48 3.44 2.6766 -2 2 1 1 33.59 1.92 2.6682 0 1 2 1 33.83 6.55 2.6495 1 0 2 1 34.20 2.52 2.6220 1 -3 1 1 34.46 1.02 2.6023 0 2 1 1 35.04 1.01 2.5608 -1 -2 1 1 35.43 2.39 2.5336 -2 0 2 1 35.79 2.74 2.5087 -2 1 2 1 36.05 5.90 2.4916 -1 3 0 1 36.10 14.68 2.4878 0 -1 3 1 37.26 5.60 2.4134 1 -3 2 1 37.44 4.08 2.4019 2 -3 1 1 37.57 1.91 2.3943 2 0 1 1 37.67 11.38 2.3878 -2 3 0 1 38.02 1.47 2.3666 1 2 0 1 38.10 3.62 2.3620 -1 0 3 1 38.10 2.03 2.3619 -1 -1 3 1 38.23 15.95 2.3543 -2 -1 1 1 38.27 17.69 2.3521 0 -3 1 1 38.34 3.51 2.3477 0 -2 3 1 38.57 1.13 2.3340 2 -2 2 1 39.10 2.70 2.3041 0 0 3 1 39.64 4.57 2.2738 0 -3 2 1 39.77 1.48 2.2665 -1 2 2 1 40.40 4.51 2.2325 2 -1 2 1 40.69 4.96 2.2176 2 1 0 1 41.07 2.20 2.1976 1 -1 3 1 41.24 2.80 2.1892 -2 2 2 1 41.37 2.01 2.1824 0 3 0 1 41.70 15.10 2.1660 2 -3 2 1 42.81 1.06 2.1124 -3 1 1 1 42.99 1.88 2.1038 -1 -2 3 1 43.12 2.84 2.0981 -3 1 0 1 43.43 1.61 2.0837 -3 2 1 1 43.72 3.28 2.0704 -2 0 3 1 44.36 2.58 2.0422 1 -3 3 1 44.75 7.86 2.0250 0 2 2 1 44.86 4.07 2.0206 3 -2 1 1 45.01 4.16 2.0142 1 2 1 1 45.64 1.48 1.9877 -2 1 3 1 46.31 2.91 1.9606 -2 -1 3 1 46.47 6.25 1.9543 0 1 3 1 46.56 1.01 1.9504 -3 1 2 1 46.71 1.66 1.9448 3 -3 1 1 46.78 1.66 1.9418 1 -4 1 1 46.88 5.27 1.9379 2 -4 1 1 47.06 1.17 1.9312 2 1 1 1 47.43 6.28 1.9170 3 -1 1 1 48.08 1.87 1.8924 -1 -3 1 1 48.24 1.23 1.8864 0 3 1 1 48.33 6.14 1.8833 2 -2 3 1 48.68 6.55 1.8705 -3 2 2 1 48.75 3.90 1.8679 -3 0 2 1 48.82 2.35 1.8655 -2 -2 1 1 49.00 2.27 1.8590 2 -4 2 1 49.02 3.20 1.8584 -2 -2 2 1 49.49 1.93 1.8417 2 -3 3 1 49.55 4.04 1.8396 -1 -1 4 1 49.74 4.69 1.8332 -1 4 0 1 50.40 2.41 1.8105 -2 3 2 1 51.03 3.49 1.7898 -1 0 4 1 51.52 1.43 1.7739 3 -3 2 1 51.64 2.05 1.7701 -1 2 3 1 51.67 2.26 1.7690 -2 2 3 1 51.89 5.60 1.7622 1 3 0 1 52.29 1.48 1.7494 1 -2 4 1 52.31 1.42 1.7488 2 2 0 1 52.99 1.52 1.7280 0 0 4 1 53.72 1.79 1.7062 -3 1 3 1 54.31 2.53 1.6893 1 -1 4 1 54.31 3.40 1.6890 -3 0 3 1 54.40 1.16 1.6864 -3 -1 1 1 54.49 3.42 1.6839 -2 0 4 1 54.72 2.33 1.6774 -3 3 2 1 55.01 1.41 1.6692 3 -1 2 1 55.18 1.57 1.6644 1 1 3 1 55.20 1.26 1.6641 0 -4 3 1 55.70 1.83 1.6503 3 -4 2 1 56.07 1.35 1.6401 -1 4 1 1 56.20 1.03 1.6368 0 4 0 1 56.91 1.70 1.6181 0 2 3 1 57.09 2.09 1.6134 -4 2 0 1 57.09 3.11 1.6132 -4 2 1 1 57.41 1.44 1.6052 3 1 0 1 57.49 2.60 1.6030 -2 1 4 1 57.84 1.79 1.5941 -4 3 0 1 58.53 1.45 1.5770 -1 -3 4 1 58.89 1.12 1.5682 1 3 1 1 59.18 1.18 1.5612 -4 3 1 1 59.40 1.75 1.5560 3 -3 3 1 59.90 1.40 1.5442 1 -4 4 1 59.92 1.28 1.5438 -2 -2 4 1 60.12 1.88 1.5390 2 -2 4 1 60.42 1.29 1.5321 4 -2 1 1 62.98 1.05 1.4758 -1 3 3 1 62.98 1.52 1.4758 1 -5 3 1 63.09 1.32 1.4736 2 -5 3 1 63.13 2.02 1.4728 0 4 1 1 63.97 1.01 1.4554 -4 0 1 1 63.99 1.13 1.4550 -2 2 4 1 64.01 2.34 1.4545 2 -1 4 1 64.62 1.03 1.4423 -1 5 0 1 64.97 3.00 1.4354 -3 -2 1 1 65.56 1.46 1.4238 -3 -1 4 1 65.85 1.26 1.4183 -4 1 3 1 66.65 1.50 1.4032 1 2 3 1 67.94 1.08 1.3796 -1 -4 4 1 68.04 2.25 1.3778 -1 -3 5 1 68.21 1.17 1.3750 -3 5 1 1 68.91 1.93 1.3626 3 2 0 1 69.30 2.21 1.3560 4 -5 1 1 70.35 1.28 1.3383 -4 4 2 1 70.60 1.23 1.3341 0 2 4 1 70.98 1.87 1.3279 -2 1 5 1 72.04 1.88 1.3110 2 -6 2 1 72.67 1.23 1.3012 0 4 2 1 73.64 1.26 1.2864 2 -2 5 1 74.03 1.20 1.2805 2 -4 5 1 74.04 1.42 1.2804 -2 -4 2 1 78.27 1.16 1.2215 5 -2 1 1 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.