COL ICSD Collection Code 68999 DATE Recorded Jan 20, 1992 NAME Lead dodecaaluminate FORM Pb (Al12 O19) = Al12 O19 Pb TITL Refinement of the structure of lead hexaaluminate (PbAl12O19) REF Journal of Solid State Chemistry JSSCB 85 (1990) 318-320 AUT Iyi N, TakekawaÿS, KimuraÿS CELL a=5.571 b=5.571 c=22.045 à=90.0 á=90.0 ç=120.0 V=592.5 Z=2 SGR P 63/m m c (194) - hexagonal CLAS 6/mmm (Hermann-Mauguin) - D6h (Schoenflies) PRS hP64 ANX AB12X19 PARM Atom__No OxStat Wyck ---X--- ---Y--- ---Z--- -SOF- Pb 1 2.000 2d 2/3 1/3 1/4 Al 1 3.000 12k 0.8317 0.6634 0.108 Al 2 3.000 4f 1/3 2/3 0.02809 Al 3 3.000 4f 1/3 2/3 0.19013 Al 4 3.000 2a 0. 0. 0. Al 5 3.000 4e 0. 0. 0.2406 0.5 O 1 -2.000 12k 0.1545 0.309 0.0519 O 2 -2.000 12k 0.5016 0.0032 0.1471 O 3 -2.000 4f 2/3 1/3 0.0541 O 4 -2.000 4e 0. 0. 0.1479 O 5 -2.000 6h 0.1823 0.3646 1/4 WYCK k3 h f3 e2 d a ÿ TF Atom á(1,1) á(2,2) á(3,3) á(1,2) á(1,3) á(2,3) Pb 1 0.0112 0.0112 0.0008 0.0056 0.0000 0.0000 Al 1 0.0033 0.0030 0.0002 0.0015 0.0000 0.0001 Al 2 0.0030 0.0030 0.0001 0.0015 0.0000 0.0000 Al 3 0.0034 0.0034 0.0002 0.0017 0.0000 0.0000 Al 4 0.0021 0.0021 0.0003 0.0010 0.0000 0.0000 Al 5 0.0031 0.0031 0.0010 0.0016 0.0000 0.0000 O 1 0.0045 0.0034 0.0002 0.0017 -0.0000 -0.0001 O 2 0.0041 0.0057 0.0001 0.0029 0.0001 0.0001 O 3 0.0019 0.0019 0.0003 0.0010 0.0000 0.0000 O 4 0.0014 0.0014 0.0004 0.0007 0.0000 0.0000 O 5 0.0050 0.0098 0.0004 0.0049 0.0000 0.0000 RVAL 0.043