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Tomichite |
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Grey I E, Madsen I C, Harris D C |
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American Mineralogist 72 (1987) 201-208 |
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Barian tomichite, Ba.5(As2).5Ti2(V,Fe)5O13(OH), its crystal structure and |
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relationship to derbylite and tomichite |
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_database_code_amcsd 0001066 |
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7.105 14.217 5.043 90 104.97 90 A2/m |
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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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Ti1 0 0 0 .55 .0086 .0078 .0087 0 .0016 0 |
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V1 0 0 0 .225 .0086 .0078 .0087 0 .0016 0 |
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Fe1 0 0 0 .225 .0086 .0078 .0087 0 .0016 0 |
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Ti2 0 .6172 0 .45 .0079 .0141 .0102 0 .0034 0 |
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V2 0 .6172 0 .275 .0079 .0141 .0102 0 .0034 0 |
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Fe2 0 .6172 0 .275 .0079 .0141 .0102 0 .0034 0 |
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Ti3 .3171 .1916 .1185 .24 .0060 .0074 .0062 -.0018 .0025 -.0007 |
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V3 .3171 .1916 .1185 .38 .0060 .0074 .0062 -.0018 .0025 -.0007 |
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Fe3 .3171 .1916 .1185 .38 .0060 .0074 .0062 -.0018 .0025 -.0007 |
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Ba .5 .5 0 .35 .0102 .0084 .0095 0 -.0028 0 |
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As .5807 0 .2396 .47 .0032 .0047 .0099 0 .0013 0 |
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O1 .1593 .0983 .2329 .008 .008 .009 -.001 .003 .000 |
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O2 .1741 .2985 .2275 .008 .010 .006 .003 .000 .001 |
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O3 .5 .2859 0 .006 .008 .006 0 .002 0 |
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O4 .5 .0947 0 .015 .008 .016 0 .002 0 |
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O5 .1488 0 .7175 .011 .009 .010 0 .004 0 |
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Tomichite |
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Grey I E, Madsen I C, Harris D C |
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American Mineralogist 72 (1987) 201-208 |
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Barian tomichite, Ba.5(As2).5Ti2(V,Fe)5O13(OH), its crystal structure and |
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relationship to derbylite and tomichite |
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_database_code_amcsd 0001067 |
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7.119 14.176 4.992 90 105.1 90 P2_1/m |
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atom x y z occ Biso |
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Ti1 .4965 .25 .7453 .6 .35 |
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V1 .4965 .25 .7453 .3 .35 |
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Fe1 .4965 .25 .7453 .1 .35 |
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Ti2 .5017 .1289 .2484 .62 .23 |
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V2 .5017 .1289 .2484 .285 .23 |
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Fe2 .5017 .1289 .2484 .095 .23 |
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Ti3 .8171 .0606 .8736 .3 .10 |
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V3 .8171 .0606 .8736 .525 .10 |
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Fe3 .8171 .0606 .8736 .175 .10 |
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Ti4 .8195 -.0620 .3755 .27 .15 |
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V4 .8195 -.0620 .3755 .55 .15 |
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Fe4 .8195 -.0620 .3755 .18 .15 |
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As .0789 .25 .0125 .47 |
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O1 .342 .25 .033 .01 |
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O2 .673 -.047 -.023 .50 |
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O3 .654 .152 -.023 .19 |
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O4 .003 .155 .756 .52 |
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O5 .002 .034 .252 .45 |
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O6 .677 .048 .483 .34 |
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O7 .342 .152 .516 .43 |
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O8 .647 .25 .458 .38 |
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Hawthorneite |
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Grey I E, Madsen I C, Haggerty S E |
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American Mineralogist 72 (1987) 633-636 |
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Structure of a new upper-mantle, magnetoplumbite-type phase, Ba(Ti3Cr4Fe4Mg)O19 |
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_database_code_amcsd 0001094 |
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5.871 5.871 23.06 90 90 120 P6_3/mmc |
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atom x y z occ Biso |
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Ba 1/3 2/3 .75 .85 .70 |
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K 1/3 2/3 .75 .12 .70 |
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Cr1 0 0 0 .36 |
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Fe2 0 0 .2571 .5 .70 |
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Fe3 1/3 2/3 .0268 .64 .49 |
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Mg3 1/3 2/3 .0268 .36 .49 |
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Ti4 1/3 2/3 .1888 .35 |
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Cr5 .1662 .3324 -.1063 .62 .44 |
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Ti5 .1662 .3324 -.1063 .17 .44 |
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Fe5 .1662 .3324 -.1063 .21 .44 |
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O1 0 0 .1512 .44 |
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O2 1/3 2/3 -.0599 .43 |
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O3 .1878 .3756 .25 1.36 |
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O4 .1483 .2966 .0548 .39 |
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O5 .5020 .0040 .1508 .49 |
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Lucasite-(Ce) |
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Nickel E H, Grey I E, Madsen I C |
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American Mineralogist 72 (1987) 1006-1010 |
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Lucasite-(Ce), CeTi2(O,OH)6, a new mineral from Western Australia: Its |
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description and structure |
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_database_code_amcsd 0001128 |
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5.178 8.756 9.768 90 93.52 90 I2/a |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Ce .25 .1894 0 .0111 .0160 .0119 0 .0011 0 |
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Ti .2187 .9154 .2651 .0122 .0101 .0163 .0003 .0006 .0014 |
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O1 .6007 .2541 .1411 .016 .011 .016 .001 .0000 .0000 |
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O2 .4083 .0799 .3692 .014 .011 .022 -.003 .008 -.006 |
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O3 .9976 .0450 .1402 .012 .017 .014 .006 .003 .002 |
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Anthoinite |
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Grey I E, Madsen I C, Mills S J, Hatert F, Peterson V K, Bastow T J |
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American Mineralogist 95 (2010) 639-645 |
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A new type of cubic-stacked layer structure in anthoinite, AlWO3(OH)3 |
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Locality: Mt Misobo Mine, Democratic Republic of the Congo |
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_database_code_amcsd 0018557 |
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8.196 9.187 11.316 92.82 94.08 90.23 I-1 |
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atom x y z occ Biso |
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Al1 .759 .4972 .8687 .685 2.19 |
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W1 .759 .4972 .8687 .315 2.19 |
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W2 .0477 .2475 .7542 .70 2.19 |
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Al2 .0477 .2475 .7542 .30 2.19 |
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Al3 .450 .254 .233 .875 2.19 |
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W3 .450 .254 .233 .125 2.19 |
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W4 .2408 .5139 .6304 .78 2.19 |
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Al4 .2408 .5139 .6304 .22 2.19 |
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O1 .751 .625 .707 2.02 |
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O2 .222 .107 .708 2.02 |
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O3 .897 .827 .590 2.02 |
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O4 .432 .173 .900 2.02 |
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O5 .571 .104 .188 2.02 |
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O6 .420 .626 .688 2.02 |
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O7 .417 .614 .200 2.02 |
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O8 .415 .886 .323 2.02 |
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O9 .391 .355 .610 2.02 |
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O10 .419 .167 .405 2.02 |
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O11 .305 .964 .535 2.02 |
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O12 .743 .407 .517 2.02 |
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H1 .205 .055 .649 .74 .95 |
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H2A .424 .266 .030 .67 .95 |
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H2B .415 .345 .018 .33 .95 |
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H3 .239 .059 .164 .95 |
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H4 .996 .417 .597 .95 |
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H5A .297 .909 .086 .53 .95 |
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H5B .295 .992 .054 .47 .95 |
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H5C .228 .786 .002 .53 .95 |
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H6 .099 .285 .027 .63 .95 |
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H7 .900 .419 .007 .50 .95 |
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Vikingite |
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Makovicky E, Mumme W G, Madsen I C |
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Neues Jahrbuch fur Mineralogie, Monatshefte 1992 (1992) 454-468 |
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The crystal structure of vikingite |
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Locality: La Roche Balue, France |
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_database_code_amcsd 0014865 |
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13.598 4.112 25.2490 90 95.59 90 C2/m |
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atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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BiMe1 .3703 0 .0394 .97 .0518 .0263 .0150 0 .0142 0 |
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AgMe1 .3703 0 .0394 .03 .0518 .0263 .0150 0 .0142 0 |
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AgMe2 .1023 0 .1073 .48 .0550 .0380 .0278 0 .0111 0 |
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BiMe2 .1023 0 .1073 .52 .0550 .0380 .0278 0 .0111 0 |
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PbMe3 .3497 .5 .1935 .0515 .0340 .0387 0 .0119 0 |
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AgMe4 .1333 0 .2829 .38 .0785 .0432 .0288 0 .0126 0 |
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PbMe4 .1333 0 .2829 .22 .0785 .0432 .0288 0 .0126 0 |
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BiMe4 .1333 0 .2829 .4 .0785 .0432 .0288 0 .0126 0 |
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BiMe5 .4261 0 .3514 .0513 .0286 .0169 0 .0134 0 |
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PbMe6 .2152 .5 .4268 .0532 .0345 .0208 0 .0150 0 |
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PbMe7 0 0 .5 .0573 .0294 .0214 0 .0151 0 |
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S1 0 0 0 .0466 |
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S2 .2566 .5 .0753 .0315 |
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S3 .4778 0 .1295 .0318 |
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S4 .2095 0 .1948 .0370 |
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S5 .5009 0 .2602 .0230 |
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S6 .2942 .5 .3174 .0181 |
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S7 .0693 0 .3914 .0172 |
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S8 .3560 0 .4668 .0137 |
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|
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