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Mottramite |
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Permer L, Laligant Y, Ferey G |
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European Journal of Solid State and Inorganic Chemistry 30 (1993) 383-392 |
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Crystal structure of (Pb2.8Fe1.2)Cu4O1.6(VO4)4(OH)2; |
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structural relationships with mineral gamagarite |
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_cod_database_code 1000426 |
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_database_code_amcsd 0012569 |
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7.525 5.900 9.640 90 90 90 Pnma |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Fe .3767 .25 .1788 .280 .0094 .0158 .0114 0 .0004 0 |
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Pb .3767 .25 .1788 .720 .0094 .0158 .0114 0 .0004 0 |
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V .8613 .25 .6710 .008 .009 .014 0 -.007 0 |
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Cu 0 0 0 .012 .007 .015 .0007 .003 -.0006 |
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O1 .176 .25 .948 .018 .006 .031 0 -.003 0 |
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O2 .540 .25 -.071 .015 .024 .019 0 -.007 0 |
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O3 .369 .488 .729 .022 .013 .022 -.003 .011 -.011 |
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O4 .856 .25 .066 .900 .015 .010 .018 0 .005 0 |
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H .74 .25 0 .5 |
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Fe4V2Mo3O20 |
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Laligant Y, Permer L, Le Bail A |
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European Journal of Solid State and Inorganic Chemistry 32 (1995) 325-334 |
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Crystal structure of Fe4V2Mo3O20 determined from conventional X-ray |
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powder diffraction data |
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_cod_database_code 1000123 |
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_database_code_amcsd 0012595 |
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9.5390 9.5390 17.1411 90 90 90 P4_122 |
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atom x y z occ |
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Mo1 .4010 .2627 .0941 .86 |
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V1 .4010 .2627 .0941 .14 |
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Mo2 0 .8386 0 .86 |
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V2 0 .8386 0 .14 |
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Mo3 .5 .8327 0 .22 |
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V3 .5 .8327 0 .78 |
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Mo4 0 .3342 0 .22 |
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V4 0 .3342 0 .78 |
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Fe1 .2485 .5918 .0601 |
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Fe2 .7462 .0930 .0612 |
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O1 .282 .152 .0534 |
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O2 .575 .222 .0745 |
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O3 .389 .443 .0640 |
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O4 .405 .248 .4268 |
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O5 .906 .745 .4255 |
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O6 .041 .110 .1969 |
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O7 .111 .571 .4535 |
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O8 .244 .640 .9443 |
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O9 .617 .059 .4542 |
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O10 .272 .913 .1861 |
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FeVMoO7 |
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Le Bail A, Permer L, Laligant Y |
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European Journal of Solid State and Inorganic Chemistry 32 (1995) 883-892 |
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Structure of FeVMoO7 |
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_cod_database_code 1000124 |
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_database_code_amcsd 0012599 |
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5.5703 6.6741 7.9032 96.174 90.260 101.273 P-1 |
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atom x y z occ |
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Fe .1702 .6903 .5978 |
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V1 .6865 .7588 .3341 .94 |
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Mo1 .6865 .7588 .3341 .06 |
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Mo2 .2999 .2103 .1082 .94 |
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V2 .2999 .2103 .1082 .06 |
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O1 .896 .638 .424 |
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O2 .212 .005 .608 |
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O3 .769 .040 .9057 |
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O4 .670 .719 .097 |
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O5 .414 .693 .410 |
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O6 .437 .703 .764 |
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O7 .928 .692 .796 |
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Fe2 O13 V4 |
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Permer L, Laligant Y |
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European Journal of Solid State and Inorganic Chemistry 34 (1997) 41-52 |
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Crystal structure of the tetrapolyvanadate Fe2 V4 O13 |
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_cod_database_code 1000431 |
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_database_code_amcsd 0012606 |
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8.3125 9.4055 14.5768 90 102.231 90 P2_1/c |
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atom x y z |
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Fe1 .9534 .0042 .2723 |
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Fe2 .569 .0061 .2526 |
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V1 .5145 .2560 -.0673 |
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V2 .1292 .2395 -.0747 |
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V3 .7119 .2788 .1600 |
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V4 .2143 .1871 .1518 |
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O1 .1209 .1905 .0467 |
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O2 .3303 .3088 -.0336 |
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O3 .6490 .2397 .0335 |
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O4 .7487 .1319 .2196 |
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O5 .7906 .8791 .3125 |
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O6 .6024 .1147 .3884 |
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O7 .5076 .8951 .1404 |
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O8 .1003 .8497 .3368 |
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O9 .9025 .8872 .1453 |
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O10 .4058 .1728 .1776 |
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O11 .0061 .1109 .3966 |
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O12 .3911 .8858 .2978 |
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O13 .116 .1151 .2336 |
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Cu6 Fe0.9 O19 V6 |
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Permer L, Laligant Y, Ferey G, Calage Y |
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Journal of Solid State Chemistry 107 (1993) 539-546 |
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Crystal structure, magnetic, and Moessbauer studies of |
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Cu6Fe0.9V6O19: a compound with relaxation effect |
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_cod_database_code 1000354 |
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_database_code_amcsd 0013787 |
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12.9399 12.9399 7.1275 90 90 120 R-3 |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Cu1 .0419 .7627 .0997 .0164 .0152 .0189 .0109 -.0005 .0000 |
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Fe1 0 0 0 .9 .0111 .0111 .0078 .0055 0 0 |
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V1 .1552 .0204 .3292 .0072 .0091 .0082 .0043 .0004 .0001 |
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O1 .4801 .5768 .1699 .0091 .0106 .0101 .0068 .0022 .0018 |
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O2 .4566 .6837 .4823 .0083 .0096 .0096 .0040 .0000 -.0002 |
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O3 0 0 .5 .0079 .007 .0081 .0040 0 0 |
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O4 .5980 .7009 .8546 .0111 .0157 .0091 .0080 .0015 -.0005 |
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