Ca Co O7 P2 Riou D, Labbe P, Goreaud M Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences 307 (1988) 1751-1756 Les pyrophosphates A(II)x M P2 O7: Synthese et etude structurale de Ba Co P2 O7 et Ba Ni P2 O7 _cod_database_code 1001374 _database_code_amcsd 0012303 CELL PARAMETERS: 6.5476 6.5441 6.5743 66.407 83.264 87.579 SPACE GROUP: P-1 X-RAY WAVELENGTH: 1.541838 Cell Volume: 256.365 Density (g/cm3): 3.535 MAX. ABS. INTENSITY / VOLUME**2: 10.63496081 RIR: 0.979 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 14.79 8.96 5.9884 0 0 1 2 16.22 19.80 5.4632 0 1 1 2 19.01 5.19 4.6673 1 0 1 2 20.09 17.68 4.4198 -1 1 0 2 20.20 1.67 4.3970 1 1 0 2 20.21 1.06 4.3942 1 1 1 2 22.23 6.73 3.9993 -1 1 1 2 27.43 8.64 3.2512 2 0 0 2 27.45 2.99 3.2490 0 2 1 2 27.49 53.92 3.2449 0 1 2 2 27.58 1.39 3.2337 1 -1 1 2 29.27 14.34 3.0510 -1 -1 1 2 29.30 74.45 3.0482 1 1 2 2 29.80 95.48 2.9985 0 2 0 2 29.80 4.52 2.9984 2 0 1 2 29.84 17.27 2.9942 0 0 2 2 30.08 8.92 2.9711 1 2 1 2 31.23 81.00 2.8644 -2 1 0 2 31.37 94.04 2.8520 2 1 0 2 31.44 3.76 2.8457 -1 2 1 2 32.75 1.35 2.7343 -2 0 1 2 32.79 1.19 2.7316 0 2 2 2 32.83 3.33 2.7283 -1 2 0 2 33.39 2.26 2.6837 -2 1 1 2 34.32 29.26 2.6130 -1 0 2 2 36.00 5.23 2.4946 2 -1 1 2 36.79 5.77 2.4428 2 1 2 2 36.89 12.82 2.4368 -1 2 2 2 38.56 12.79 2.3346 0 -2 1 2 38.58 7.50 2.3337 2 0 2 2 38.59 9.68 2.3330 0 -1 2 2 38.65 4.32 2.3295 -2 -1 1 2 40.44 5.97 2.2307 1 -2 1 2 41.05 6.30 2.1985 2 2 0 2 41.60 19.99 2.1708 0 1 3 2 41.67 9.75 2.1674 3 0 0 2 41.71 7.76 2.1653 -1 -2 1 2 42.32 1.76 2.1357 1 1 3 2 42.78 15.44 2.1136 3 0 1 2 43.26 8.85 2.0912 0 3 2 2 43.27 4.04 2.0912 -2 0 2 2 43.30 10.12 2.0894 0 2 3 2 43.44 5.07 2.0834 1 3 1 2 44.02 1.62 2.0569 1 2 3 2 44.39 7.37 2.0410 -1 3 1 2 44.52 1.23 2.0350 3 1 0 2 44.56 10.95 2.0334 1 3 2 2 45.35 11.32 1.9996 -2 2 2 2 45.37 3.98 1.9990 0 3 0 2 45.58 1.40 1.9901 -1 1 3 2 45.85 9.06 1.9793 2 -1 2 2 46.53 4.79 1.9519 -3 1 1 2 46.83 1.44 1.9398 2 -2 1 2 47.14 1.11 1.9278 -1 2 3 2 47.52 2.45 1.9135 -1 3 0 2 47.66 1.76 1.9080 1 3 0 2 47.68 1.30 1.9075 3 1 2 2 49.11 7.94 1.8550 3 0 2 2 50.08 1.89 1.8216 -2 -1 2 2 50.16 2.05 1.8187 2 3 2 2 50.97 5.45 1.7917 0 -2 2 2 50.99 2.19 1.7909 2 0 3 2 51.25 14.26 1.7826 3 2 2 2 51.35 2.29 1.7793 -2 3 1 2 51.93 2.05 1.7609 -3 2 0 2 51.96 2.05 1.7598 -3 2 1 2 52.00 1.36 1.7585 1 -2 2 2 52.20 1.02 1.7523 3 2 0 2 53.43 1.74 1.7148 -2 1 3 2 53.50 14.55 1.7129 -3 1 2 2 53.70 12.51 1.7068 -2 3 0 2 53.88 6.54 1.7017 0 -1 3 2 53.97 7.45 1.6990 2 3 0 2 54.01 5.24 1.6977 -1 -2 2 2 54.80 3.21 1.6750 -2 2 3 2 54.95 1.49 1.6709 -3 0 2 2 55.26 3.09 1.6622 1 -3 1 2 55.43 6.11 1.6576 2 3 3 2 56.32 5.19 1.6335 -1 -3 1 2 56.36 2.31 1.6326 3 1 3 2 56.57 4.32 1.6268 3 -2 1 2 56.62 7.92 1.6256 4 0 0 2 56.70 1.11 1.6236 -2 0 3 2 56.87 8.34 1.6189 1 2 4 2 56.95 5.87 1.6168 2 -2 2 2 57.08 1.48 1.6137 0 4 1 2 57.29 3.65 1.6083 1 1 4 2 57.75 1.46 1.5964 1 4 2 2 58.61 1.79 1.5750 1 4 1 2 58.94 3.23 1.5669 4 1 0 2 59.15 1.97 1.5619 3 3 1 2 59.38 4.38 1.5564 -1 4 2 2 59.54 2.75 1.5526 -3 -2 1 2 60.38 1.48 1.5330 -1 2 4 2 60.45 4.22 1.5313 2 -3 1 2 60.60 4.65 1.5279 -2 3 3 2 60.69 1.47 1.5260 4 1 2 2 60.70 10.80 1.5257 0 4 3 2 60.71 3.92 1.5255 -2 -2 2 2 60.82 5.53 1.5230 -1 1 4 2 60.82 7.75 1.5229 -3 -1 2 2 60.90 2.02 1.5213 1 3 4 2 61.15 1.86 1.5157 2 1 4 2 61.31 1.12 1.5120 1 4 3 2 61.89 1.92 1.4993 0 4 0 2 61.89 4.95 1.4992 4 0 2 2 62.07 3.77 1.4952 1 0 4 2 63.77 2.30 1.4594 4 2 2 2 64.03 5.59 1.4541 -3 3 2 2 64.13 1.25 1.4521 -2 -1 3 2 64.19 1.59 1.4510 -3 1 3 2 64.23 3.12 1.4501 -1 3 4 2 65.13 1.29 1.4322 -4 2 0 2 65.15 3.36 1.4318 -2 4 1 2 65.24 1.09 1.4300 3 -2 2 2 65.45 9.12 1.4260 4 2 0 2 65.61 2.90 1.4228 -2 4 2 2 65.69 1.87 1.4215 0 -3 2 2 66.18 2.64 1.4121 1 -2 3 2 66.57 1.83 1.4048 3 -1 3 2 67.36 2.56 1.3902 -4 1 2 2 68.05 3.58 1.3778 3 2 4 2 68.38 4.97 1.3719 3 1 4 2 68.75 2.53 1.3654 -1 -2 3 2 68.89 4.76 1.3630 1 4 4 2 68.89 1.42 1.3630 3 -3 1 2 69.13 1.56 1.3588 2 4 0 2 70.11 1.37 1.3422 2 -2 3 2 70.55 2.20 1.3349 3 4 2 2 70.72 1.29 1.3321 1 -1 4 2 70.84 1.28 1.3301 4 3 2 2 71.23 2.39 1.3238 4 3 1 2 71.75 1.89 1.3155 3 3 4 2 71.80 3.11 1.3148 1 -4 1 2 72.72 3.80 1.3003 3 0 4 2 73.23 1.12 1.2926 1 5 2 2 73.92 1.66 1.2822 -4 -1 2 2 73.98 5.53 1.2813 -1 -1 4 2 74.19 1.07 1.2782 0 5 1 2 74.30 1.26 1.2766 -2 -3 2 2 75.54 1.25 1.2586 5 1 2 2 75.58 1.38 1.2580 4 3 0 2 76.13 1.07 1.2503 5 -1 1 2 76.35 1.28 1.2473 4 -2 2 2 77.47 5.13 1.2321 -3 2 4 2 78.46 1.13 1.2190 -4 2 3 2 78.72 3.39 1.2156 2 5 3 2 79.26 2.08 1.2087 3 4 4 2 80.83 2.03 1.1891 3 -1 4 2 81.39 2.22 1.1824 -2 5 1 2 82.16 3.48 1.1731 -3 0 4 2 82.77 1.61 1.1661 1 -2 4 2 83.02 2.31 1.1632 -2 5 3 2 83.41 2.21 1.1588 4 4 3 2 84.06 1.97 1.1514 3 -4 1 2 85.75 2.70 1.1330 -5 2 2 2 85.87 2.21 1.1317 -4 4 1 2 86.81 1.13 1.1219 -3 -4 1 2 89.53 2.26 1.0947 1 5 5 2 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.