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Volborthite |
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Kashaev A A, Bakakin V V |
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Doklady Akademii Nauk SSSR 181 (1968) 967-969 |
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Crystal structure of volborthite Cu3(OH)2V2O7*2H2O |
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_database_code_amcsd 0018666 |
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10.60 5.86 7.21 90 95.08 90 C2/m |
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atom x y z Biso |
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Cu1 0 0 0 1.4 |
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Cu2 .25 .25 0 1.4 |
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V .496 0 .256 1.4 |
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O1 0 .5 .5 1.4 |
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O2 .081 .25 .178 1.4 |
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O3 .345 0 .149 1.4 |
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OH .154 0 .848 1.4 |
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Wat .16 0 .45 1.4 |
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Volborthite |
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Lafontaine M A, LeBail A, Ferey G |
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Journal of Solid State Chemistry 85 (1990) 220-227 |
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Copper-containing minerals - I. Cu3V2O7(OH)2,2H2O: The synthetic homolog |
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of volborthite; crystal structure determination from X-ray and neutron data; |
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structural correlations |
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Note: neutron data on a synthetic sample |
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_database_code_amcsd 0013677 |
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10.607 5.864 7.214 90 94.88 90 C2/m |
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atom x y z Biso |
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Cu1 0 0 0 1.02 |
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Cu2 .25 .25 0 1.02 |
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V .9959 .5 .2516 .55 |
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O1 0 .5 .5 1.5 |
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O2 .3428 .5 .1095 1.5 |
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O3 .0756 .2635 .1864 1.5 |
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O4 .1622 .5 .8381 1.5 |
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Ow .3223 .5 .4894 1.5 |
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H1 .3501 .5 .2376 5.7 |
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H2 .3536 .3714 .5639 5.7 |
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| Download AMC data (View Text File)
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Volborthite |
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Lafontaine M A, LeBail A, Ferey G |
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Journal of Solid State Chemistry 85 (1990) 220-227 |
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Copper-containing minerals - I. Cu3V2O7(OH)2,2H2O: The synthetic homolog |
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of volborthite; crystal structure determination from X-ray and neutron data; |
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structural correlations |
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Note: X-ray data on a synthetic sample |
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_database_code_amcsd 0013678 |
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10.606 5.874 7.213 90 94.90 90 C2/m |
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atom x y z Biso |
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Cu1 0 0 0 .69 |
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Cu2 .25 .25 0 1.81 |
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V .9959 .5 .2516 .55 |
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O1 0 .5 .5 4.27 |
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O2 .3424 .5 .1143 1.55 |
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O3 .0682 .2721 .1846 1.82 |
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O4 .1548 .5 .8464 2.02 |
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Ow .3261 .5 .4788 4.71 |
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H .3501 .5 .2376 5.7 |
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H .3536 .3714 .5639 5.7 |
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Volborthite |
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Kashaev A A, Rozhdestvenskaya I V, Bannova I I, Sapozhnikov A N, Glebova O D |
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Journal of Structural Chemistry 49 (2008) 708-711 |
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Balance, uniformity, and asymmetry of the structure of volborthite |
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Cu3(OH)2(V2O7)*2H2O |
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Locality: not given |
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_database_code_amcsd 0018692 |
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10.646 5.867 14.432 90 95.19 90 Ia |
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atom x y z Uiso |
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Cu1 0 .7492 0 .0076 |
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Cu2 .24954 0 .49886 .0063 |
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Cu3 .24380 .4905 .50135 .0088 |
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V1 .00232 .2738 .87181 .0061 |
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V2 .49457 .7720 .12562 .0061 |
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O1 .5705 .0098 .0878 .0087 |
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O2 -.0678 .5021 .9140 .0140 |
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O3 .3389 .7459 .5761 .0066 |
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O4 .1558 .2439 .4252 .0133 |
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O5 .0772 .4606 .0997 .0136 |
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O6 .4262 .9532 .8983 .0114 |
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O7 .5011 .7960 .2483 .0195 |
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O-H1 .1585 .7517 .9391 .0098 |
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O-H2 .3438 .2534 .0561 .0046 |
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OW1 .3193 .2295 .7375 .032 |
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OW2 .1688 .7522 .2586 .050 |
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H1 .661 .247 .379 .017 |
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H2 .352 .242 .138 .018 |
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H3 .857 .848 .289 .084 |
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H4 .808 .865 .781 .038 |
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H5 .625 .167 .201 .063 |
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H6 .170 .620 .215 |
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Volborthite |
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Basso R, Palenzona A, Zefiro L |
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Neues Jahrbuch fur Mineralogie, Monatshefte 1988 (1988) 385-394 |
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Crystal structure refinement of volborthite from Scrava mine |
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(Eastern Liguria, Italy) |
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Note: split O1 and O5 atoms |
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Locality: Scrava mine, Eastern Liguria, Italy |
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_database_code_amcsd 0018693 |
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10.610 5.866 7.208 90 95.04 90 C2/m |
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atom x y z occ Beq B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Cu(1) 0 0 0 .73 |
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Cu(2) .25 .25 0 .76 |
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V .4965 0 .2539 1.14 |
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O(1) 0 .5473 .5 .5 1.17 .0064 .0128 .0031 0 .0004 0 |
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O(2) .0731 .2674 .1883 2.00 |
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O(3) .3416 0 .1532 .92 |
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O(4) .1577 0 .8814 .64 |
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O(5) .1773 .0311 .5187 .5 2.65 .0086 .0168 .0085 .0035 .0001 -.0038 |
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H(4) .151 0 .741 |
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H(5)A .098 0 .432 |
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H(5)B .260 0 .508 |
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| Download AMC data (View Text File)
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