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Carlfriesite |
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Effenberger H, Zemann J, Mayer H |
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American Mineralogist 63 (1978) 847-852 |
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Carlfriesite: crystal structure, revision of chemical formula, and synthesis |
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_database_code_amcsd 0000684 |
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12.576 5.662 9.994 90 115.56 90 C2/c |
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atom x y z Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Te1 .71563 .58751 .85825 .001651 .006691 .002070 -.000023 .000875 -.000421 |
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Te2 0 0 0 .001031 .005186 .000895 -.000241 .000269 -.000010 |
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Ca 0 .4404 .25 .000660 .003509 .001353 0 .000073 0 |
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O1 .0804 .2183 .6616 .76 |
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O2 .0980 .2441 .1171 .83 |
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O3 .1043 .0928 .4068 .56 |
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O4 .6839 .1042 .4098 .67 |
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Ge(OH)PO4 |
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Mayer H, Vollenkle H |
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Zeitschrift fur Kristallographie 136 (1972) 387-401 |
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Die kristallstruktur und fehlordnung von Ge(OH)PO4 |
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_database_code_amcsd 0010739 |
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12.253 7.014 7.161 90 90 90 Bmam |
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atom x y z occ Biso |
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Ge1 0 0 0 .77 |
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Ge2 .25 .5 .25 .77 |
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P1 .25 .3826 .25 .5 .77 |
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P1+ .25 .1174 0 .5 .77 |
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OH1 0 .9089 .25 .77 |
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O2 .1511 0 .5 .77 |
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OH1+ .25 .4089 0 .5 .77 |
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O3 0 .2540 .0694 .77 |
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O2+ .0989 .5000 .25 .77 |
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O3+ .2500 .7540 .3194 .5 .77 |
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Polarite |
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Mayer H W, Bhatt Y C, Schubert K |
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Journal of the Less-Common Metals 66 (1979) 1-9 |
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Kristallstrukturen von Pd2PbBi und Pd4PbBi3 |
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Locality: synthetic |
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_database_code_amcsd 0014143 |
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7.150 8.681 10.535 90 90 90 Ccm2_1 |
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atom x y z B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Pda1 .082 0 .269 .000 .008 .004 0 .000 0 |
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Pda2 .673 0 .264 .000 .015 .005 0 .000 0 |
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Pdb .119 .256 .437 .063 .010 .036 .000 -.003 .001 |
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Pbb .120 0 0 .007 .039 .021 0 .000 0 |
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Pba .638 0 .989 .009 .036 .021 0 .003 0 |
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Bib .122 .2763 .710 .007 .000 .007 -.001 -.002 .001 |
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Pd2PbBi |
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Mayer H W, Bhatt Y C, Schubert K |
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Journal of the Less-Common Metals 66 (1979) 1-9 |
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Kristallstrukturen von Pd2PbBi und Pd4PbBi3 |
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_database_code_amcsd 0014144 |
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7.171 8.677 5.575 90 71.74 90 Cm |
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atom x y z |
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Pda1 .961 0 .538 |
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Pda2 .551 0 .528 |
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Pdb .917 .256 .876 |
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Pba1 .120 0 0 |
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Pba2 .641 0 .978 |
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Bib .281 .224 .420 |
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Bayleyite |
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Mayer H, Mereiter K |
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Tschermaks Mineralogische und Petrographische Mitteilungen 35 (1986) 133-146 |
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Synthetic bayleyite, Mg2[UO2(CO3)3]*18H2O: Thermochemistry, crystallography |
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and crystal structure |
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Locality: synthetic |
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_database_code_amcsd 0015706 |
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26.560 15.256 6.505 90 92.90 90 P2_1/a |
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atom x y z occ Biso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Mg1 0 0 0 2.1 .022 .034 .023 -.003 .000 .000 |
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Mg2 .5 0 0 2.2 .028 .028 .027 -.002 .005 .000 |
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Mg3 .23864 .28485 .0223 2.2 .031 .029 .023 -.005 .001 .001 |
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U .16496 .02120 .4872 1.5 .017 .021 .019 .002 -.003 |
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O1 .17694 .0138 .7597 2.6 .034 .040 .025 .007 .000 -.004 |
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O2 .15253 .0287 .2155 2.6 .033 .042 .023 .000 .002 -.003 |
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C1 .27154 .0276 .4332 2.2 .024 .029 .031 .000 .005 -.003 |
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O11 .24439 .0972 .4631 2.9 .023 .026 .061 -.001 .007 .000 |
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O12 .24735 -.0452 .4395 2.9 .024 .024 .060 -.003 .011 -.010 |
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O13 .31811 .0323 .4078 2.9 .020 .040 .052 .001 .007 -.004 |
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C2 .11505 -.1475 .4907 2.4 .027 .023 .041 -.002 .000 .002 |
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O21 .16303 -.1370 .4593 2.6 .023 .027 .047 .002 .004 -.005 |
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O22 .09142 -.0740 .5216 2.4 .023 .025 .042 .000 .005 .000 |
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O23 .09537 -.2202 .4953 4.8 .031 .029 .123 -.007 .018 -.008 |
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C3 .10844 .1811 .5418 2.1 .029 .028 .021 .001 .001 -.001 |
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O31 .08686 .1038 .5326 2.2 .020 .024 .040 -.002 .002 -.001 |
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O32 .1568 .1801 .5208 2.3 .019 .031 .038 .000 .005 -.005 |
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O33 .08378 .2497 .5704 2.8 .029 .023 .054 .005 .004 -.002 |
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OW1 -.00218 .0698 -.2729 3.1 .027 .066 .026 -.004 .001 .012 |
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OW2 .02728 .1076 .1574 3.4 .051 .043 .033 -.016 -.007 -.001 |
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OW3 .07226 -.0424 -.0554 3.0 .026 .061 .029 -.002 .003 -.007 |
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OW4 .47544 .1199 -.1115 3.5 .052 .039 .043 .009 .007 .007 |
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OW5 .56726 .0611 .1043 2.8 .028 .045 .033 -.001 .004 .000 |
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OW6 .46946 .0286 .2739 3.3 .048 .040 .036 -.010 .017 -.009 |
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Wat7a .2357 .4183 .0827 .5 3.2 |
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Wat7b .2146 .3987 .1544 .5 3.8 |
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Wat8a .3114 .3068 -.0828 .5 3.6 |
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Wat8b .3068 .3456 -.0432 .5 2.6 |
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Wat9a .2442 .1530 -.0635 .5 3.4 |
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Wat9b .2636 .1695 -.1141 .5 3.8 |
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Wat10a .1699 .2585 .1360 .5 2.8 |
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Wat10b .1739 .2132 .0759 .5 3.6 |
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OW11 .20505 .3174 -.2581 3.2 .054 .042 .027 -.020 -.004 .008 |
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OW12 .27017 .2541 .3070 3.4 .057 .034 .037 -.016 -.013 .011 |
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OW13 .15151 .5219 -.0080 3.7 .046 .051 .045 .000 .008 .002 |
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OW14 .59825 .0726 .5168 2.9 .030 .032 .047 .000 .004 -.004 |
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OW15 .48876 .1834 .4905 3.4 .031 .035 .063 .000 -.002 -.004 |
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OW16 .07168 .2539 -.0067 3.8 .059 .036 .049 .005 .005 -.002 |
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OW17 .14850 .6487 .2996 5.5 .109 .048 .052 .024 .000 .002 |
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Wat18 .41382 .2467 .0620 10.0 .158 .130 .093 .080 -.040 -.040 |
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H1a -.03 .066 -.372 4.7 |
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H1b .028 .072 -.346 4.7 |
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H2a .043 .102 .292 4.7 |
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H2b .035 .165 .107 4.7 |
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H3a .102 -.014 0 4.7 |
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H3b .078 -.058 -.195 4.7 |
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H4a .474 .134 -.256 4.7 |
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H4b .455 .161 -.044 4.7 |
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H5a .594 .031 .041 4.7 |
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H5b .575 .061 .25 4.7 |
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H6a .447 -.006 .349 4.7 |
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H6b .476 .082 .35 4.7 |
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H11a .222 .361 -.337 4.7 |
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H11b .191 .274 -.352 4.7 |
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H12a .268 .199 .379 4.7 |
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H12b .296 .289 .376 4.7 |
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H13a .163 .532 -.144 4.7 |
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H13b .143 .577 .049 4.7 |
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H14a .632 .048 .529 4.7 |
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H14b .601 .135 .535 4.7 |
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H15a .462 .225 .507 4.7 |
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H15b .52 .215 .485 4.7 |
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H16a .063 .251 -.151 4.7 |
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H16b .065 .312 .04 4.7 |
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H17a .154 .614 .421 4.7 |
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H17b .129 .699 .336 4.7 |
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|
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