Libethenite Belik A A, Naumov P, Kim J, Tsuda S Journal of Solid State Chemistry 184 (2011) 3128-3133 Low-temperature structural phase transition in synthetic libethenite Cu2PO4OH Note: T = 120 K Locality: Synthetic _database_code_amcsd 0020446 CELL PARAMETERS: 8.0545 8.3622 5.8755 90.000 90.001 90.000 SPACE GROUP: P2_1/n X-RAY WAVELENGTH: 1.541838 Cell Volume: 395.735 Density (g/cm3): 4.012 MAX. ABS. INTENSITY / VOLUME**2: 17.74525731 RIR: 1.440 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 15.27 98.07 5.8011 1 1 0 4 18.46 100.00 4.8075 0 1 1 4 18.69 42.07 4.7468 -1 0 1 2 18.69 35.69 4.7467 1 0 1 2 21.25 1.86 4.1811 0 2 0 2 21.53 2.36 4.1281 -1 1 1 4 22.07 1.98 4.0272 2 0 0 2 23.98 54.67 3.7109 1 2 0 4 24.53 21.34 3.6284 2 1 0 4 30.43 10.08 2.9378 0 0 2 2 30.83 91.82 2.9006 2 2 0 4 32.30 1.53 2.7717 0 1 2 4 34.04 53.14 2.6341 1 3 0 4 34.21 49.43 2.6209 -1 1 2 4 34.21 41.69 2.6208 1 1 2 4 34.48 13.20 2.6009 -2 2 1 4 34.48 15.02 2.6009 2 2 1 4 35.10 43.45 2.5563 3 1 0 4 35.65 20.04 2.5184 0 3 1 4 36.81 11.80 2.4420 -3 0 1 2 36.81 9.17 2.4419 3 0 1 2 37.41 14.52 2.4037 0 2 2 4 37.41 13.86 2.4036 -1 3 1 4 37.41 20.93 2.4036 1 3 1 4 37.91 15.46 2.3734 -2 0 2 2 37.91 21.31 2.3734 2 0 2 2 38.40 10.44 2.3441 -3 1 1 4 38.40 6.34 2.3440 3 1 1 4 39.11 11.85 2.3034 -1 2 2 4 39.11 24.82 2.3033 1 2 2 4 39.90 5.72 2.2592 3 2 0 4 43.86 7.71 2.0640 -2 2 2 4 43.86 6.39 2.0640 2 2 2 4 45.02 1.27 2.0136 4 0 0 2 46.29 1.87 1.9612 -1 3 2 4 46.29 3.61 1.9612 1 3 2 4 46.38 1.99 1.9577 4 1 0 4 46.99 2.75 1.9337 3 3 0 4 47.13 3.54 1.9285 -3 1 2 4 47.13 3.51 1.9284 3 1 2 4 47.52 6.65 1.9132 -1 4 1 4 47.52 5.06 1.9132 1 4 1 4 47.69 6.31 1.9069 0 1 3 4 47.79 4.41 1.9031 -1 0 3 2 47.79 4.01 1.9030 1 0 3 2 49.05 6.11 1.8573 -4 1 1 4 49.05 5.40 1.8573 4 1 1 4 49.10 1.83 1.8556 1 1 3 4 49.10 2.53 1.8555 2 4 0 4 50.29 4.04 1.8142 4 2 0 4 50.51 2.21 1.8071 -2 3 2 4 50.51 2.54 1.8071 2 3 2 4 50.99 4.60 1.7909 -3 2 2 4 51.00 1.24 1.7908 3 2 2 4 51.53 1.02 1.7736 0 2 3 4 52.81 1.14 1.7335 -4 2 1 4 52.81 2.38 1.7334 4 2 1 4 53.82 36.88 1.7033 0 4 2 4 55.31 11.15 1.6609 -4 0 2 2 55.31 9.91 1.6609 4 0 2 2 56.17 11.15 1.6375 1 5 0 4 56.71 3.21 1.6232 -2 2 3 4 56.71 2.73 1.6231 2 2 3 4 57.02 14.11 1.6152 -3 3 2 4 57.02 14.59 1.6152 3 3 2 4 57.27 4.00 1.6085 0 5 1 4 57.51 3.01 1.6025 0 3 3 4 58.08 3.26 1.5881 -3 4 1 4 58.08 4.16 1.5881 3 4 1 4 58.32 3.66 1.5823 -3 0 3 2 58.32 5.05 1.5822 3 0 3 2 58.33 7.30 1.5818 5 1 0 4 58.51 4.61 1.5774 -1 5 1 4 58.51 6.26 1.5774 1 5 1 4 58.71 3.03 1.5727 -4 3 1 4 58.71 3.62 1.5727 4 3 1 4 58.75 1.05 1.5717 -1 3 3 4 58.75 3.18 1.5717 1 3 3 4 58.87 7.38 1.5688 -2 4 2 4 58.87 5.78 1.5688 2 4 2 4 59.45 3.76 1.5547 -3 1 3 4 59.46 1.53 1.5547 3 1 3 4 59.92 14.75 1.5436 -4 2 2 4 59.93 13.63 1.5436 4 2 2 4 60.62 4.27 1.5274 -5 1 1 4 60.63 3.08 1.5274 5 1 1 4 61.71 5.26 1.5032 5 2 0 4 63.31 18.45 1.4689 0 0 4 2 64.22 23.21 1.4503 4 4 0 4 65.23 1.72 1.4303 -1 5 2 4 65.23 1.91 1.4303 1 5 2 4 65.41 2.26 1.4268 4 3 2 4 65.56 1.24 1.4239 -1 1 4 4 65.56 2.21 1.4239 1 1 4 4 66.43 1.73 1.4073 -1 4 3 4 67.11 1.34 1.3947 5 3 0 4 67.22 1.54 1.3928 -5 1 2 4 67.22 2.61 1.3927 5 1 2 4 67.67 2.00 1.3846 -4 1 3 4 67.67 1.17 1.3846 4 1 3 4 68.30 2.22 1.3733 1 6 0 4 68.65 2.81 1.3671 -2 5 2 4 68.65 3.01 1.3671 2 5 2 4 68.73 3.84 1.3658 1 2 4 4 70.10 2.37 1.3424 6 0 0 2 70.35 3.05 1.3382 -5 2 2 4 70.35 4.51 1.3382 5 2 2 4 70.79 1.34 1.3309 4 2 3 4 71.13 1.21 1.3254 6 1 0 4 71.65 6.04 1.3171 2 6 0 4 72.07 5.79 1.3104 -2 2 4 4 72.07 5.30 1.3104 2 2 4 4 72.71 2.60 1.3005 -4 4 2 4 72.71 1.64 1.3004 4 4 2 4 73.72 1.29 1.2852 -2 6 1 4 73.87 4.92 1.2829 -1 3 4 4 73.87 3.74 1.2829 1 3 4 4 74.19 3.47 1.2782 -3 5 2 4 74.19 2.47 1.2782 6 2 0 4 74.19 3.61 1.2781 3 5 2 4 74.50 3.80 1.2736 -3 1 4 4 74.50 4.15 1.2736 3 1 4 4 74.62 1.75 1.2718 0 5 3 4 75.45 3.88 1.2600 -5 3 2 4 75.45 2.66 1.2599 5 3 2 4 75.50 5.04 1.2592 0 6 2 4 75.67 1.57 1.2568 -4 5 1 4 75.71 1.78 1.2563 1 5 3 4 75.88 1.64 1.2539 -4 3 3 4 76.23 1.11 1.2489 6 2 1 4 76.38 1.27 1.2470 -5 4 1 4 76.58 1.16 1.2441 1 6 2 4 77.51 1.44 1.2315 -3 2 4 4 77.58 2.03 1.2306 -5 1 3 4 77.58 3.74 1.2306 5 1 3 4 78.31 1.93 1.2210 -6 0 2 2 78.31 1.08 1.2210 6 0 2 2 81.71 1.01 1.1785 4 5 2 4 82.38 1.08 1.1706 0 7 1 4 83.28 1.13 1.1602 5 5 0 4 84.04 1.10 1.1517 2 4 4 4 84.55 1.85 1.1460 4 6 0 4 89.37 3.10 1.0963 -1 7 2 4 89.37 2.82 1.0963 1 7 2 4 89.67 2.77 1.0934 -1 5 4 4 89.67 1.71 1.0934 1 5 4 4 89.87 4.53 1.0914 3 7 0 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.