Ba2 Ca0.5 Cu2 Nd0.5 O6.86 Tl0.95 Michel C, Suard E, Caignaert V, Martin C, Maignan A, Hervieu M, Raveau B Physica C 178 (1991) 29-36 Neutron diffraction structure determination of the "1212"-series TlBa2Ca1-xNdxCu2O7-d _cod_database_code 1001485 _database_code_amcsd 0015023 CELL PARAMETERS: 3.8768 3.8768 12.6045 90.000 90.000 90.000 SPACE GROUP: P4/mmm X-RAY WAVELENGTH: 1.541838 Cell Volume: 189.437 Density (g/cm3): 6.989 MAX. ABS. INTENSITY / VOLUME**2: 156.7452610 RIR: 7.303 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 7.01 4.34 12.6045 0 0 1 2 14.05 1.01 6.3022 0 0 2 2 21.15 1.24 4.2015 0 0 3 2 24.02 11.79 3.7055 1 0 1 8 27.00 47.62 3.3020 1 0 2 8 28.32 6.71 3.1511 0 0 4 2 31.40 100.00 2.8492 1 0 3 8 32.67 74.02 2.7413 1 1 0 4 33.45 4.96 2.6787 1 1 1 8 35.61 17.33 2.5209 0 0 5 2 36.75 14.70 2.4452 1 0 4 8 42.79 2.31 2.1134 1 0 5 8 43.06 3.63 2.1007 0 0 6 2 43.77 16.83 2.0682 1 1 4 8 46.87 33.27 1.9384 2 0 0 4 49.10 14.59 1.8556 1 1 5 8 49.34 3.68 1.8470 1 0 6 8 50.70 1.70 1.8006 0 0 7 2 53.34 1.13 1.7176 2 1 1 16 54.93 8.99 1.6716 2 1 2 16 55.08 5.92 1.6674 1 1 6 8 55.67 2.61 1.6510 2 0 4 8 56.34 11.37 1.6331 1 0 7 8 57.50 26.44 1.6027 2 1 3 16 58.59 2.45 1.5756 0 0 8 2 60.22 10.01 1.5366 2 0 5 8 61.00 6.64 1.5190 2 1 4 16 61.63 2.32 1.5050 1 1 7 8 63.76 3.46 1.4596 1 0 8 8 65.52 2.49 1.4246 2 0 6 8 68.45 7.49 1.3706 2 2 0 4 68.72 2.68 1.3660 1 1 8 8 70.41 1.39 1.3372 2 1 6 16 71.52 2.55 1.3193 2 0 7 8 75.03 1.22 1.2659 3 0 2 8 75.41 1.00 1.2605 0 0 10 2 76.23 6.40 1.2489 2 1 7 16 76.36 1.72 1.2472 1 1 9 8 77.24 4.16 1.2352 3 0 3 8 77.93 6.61 1.2259 3 1 0 8 78.18 2.77 1.2226 2 0 8 8 79.62 2.98 1.2042 2 2 5 8 80.30 1.50 1.1956 3 0 4 8 82.78 2.19 1.1660 2 1 8 16 84.63 2.26 1.1452 1 1 10 8 84.87 1.88 1.1425 3 1 4 16 88.73 2.64 1.1025 3 1 5 16 89.10 4.22 1.0989 1 0 11 8 89.96 1.58 1.0906 2 2 7 8 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.