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Pucherite |
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Qurashi M M, Barnes W H |
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American Mineralogist 37 (1952) 423-426 |
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A preliminary structure for pucherite, BiVO4 |
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_database_code_amcsd 0000054 |
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5.332 5.060 12.02 90 90 90 Pnca |
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atom x y z |
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Bi .25 0 .108 |
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V .25 0 .392 |
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O1 0 0 0 |
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O2 0 0 .5 |
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O3 -.033 .283 .217 |
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Pucherite |
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Qurashi M M, Barnes W H |
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American Mineralogist 38 (1953) 489-500 |
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The structure of pucherite, BiVO4 |
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_database_code_amcsd 0000057 |
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5.332 5.060 12.020 90 90 90 Pnca |
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atom x y z Biso |
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Bi .25 0 .1097 1.3 |
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V .25 0 .3938 1.3 |
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O1 -.0525 -.2292 .0316 1.3 |
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O2 -.0300 .3498 .1955 1.3 |
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Pyrobelonite |
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Donaldson D M, Barnes W H |
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American Mineralogist 40 (1955) 580-596 |
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The structures of the minerals of the descloizite and adelite groups: II - |
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pyrobelonite. |
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_database_code_amcsd 0000071 |
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7.663 6.191 9.522 90 90 90 Pnma |
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atom x y z Biso |
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Pb .1341 .25 .1776 1.0 |
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Mn 0 0 .5 0.6 |
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V .3654 .75 .3128 0.8 |
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O1 .184 .75 .437 |
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O2 .540 .75 .408 |
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O3 .371 .513 .209 |
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O4 .371 .987 .209 |
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OH .139 .25 .417 |
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Brackebuschite |
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Donaldson D M, Barnes W H |
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American Mineralogist 40 (1955) 597-613 |
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The structures of the minerals of the descloizite and adelite groups: |
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III - brackebuschite |
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_database_code_amcsd 0000072 |
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7.681 6.155 16.524 90 93.75 90 B2_1/m |
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atom x y z Biso |
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Pb1 .1149 .25 .3745 1.9 |
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Pb2 .6233 .25 .2989 1.9 |
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V1 .6462 .25 .0865 0.5 |
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V2 .1233 .25 .1644 0.5 |
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Mn 0 0 0 1.5 |
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O1 .114 .023 .104 |
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O2 .941 .25 .230 |
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O3 .299 .25 .247 |
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O4 .632 .023 .145 |
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O5 .455 .25 .017 |
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O6 .846 .25 .024 |
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Lindgrenite |
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Calvert L D, Barnes W H |
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The Canadian Mineralogist 6 (1957) 31-51 |
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The structure of lindgrenite |
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_database_code_amcsd 0005073 |
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5.61 14.03 5.40 90 98.38 90 P2_1/n |
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atom x y z Biso |
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Cu1 0 0 0 .53 |
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Cu2 .4885 .0942 .8642 .53 |
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Mo .8769 .1544 .4552 .53 |
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O1 .432 .221 .977 1.0 |
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O2 .096 .094 .642 1.0 |
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O3 .600 .130 .554 1.0 |
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O4 .866 .112 .149 1.0 |
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OH .341 .031 .123 1.0 |
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Vanadinite |
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Trotter J, Barnes W H |
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The Canadian Mineralogist 6 (1958) 161-173 |
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The structure of vanadinite |
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_database_code_amcsd 0005076 |
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10.331 10.331 7.343 90 90 120 P6_3/m |
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atom x y z Biso |
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Pb1 1/3 2/3 .0054 1.5 |
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Pb2 .2558 .0107 .25 1.5 |
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V .4046 .3787 .25 1.5 |
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Cl 0 0 0 1.5 |
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O1 .3309 .5005 .25 2.6 |
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O2 .6006 .4604 .25 2.6 |
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O3 .3812 .2873 .0463 2.6 |
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Metarossite |
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Kelsey C H, Barnes W H |
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The Canadian Mineralogist 6 (1960) 448-466 |
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The crystal structure of metarossite |
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Locality: Thompson's, Utah, USA |
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_database_code_amcsd 0005077 |
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6.21 7.06 7.76 92.97 96.65 105.78 P-1 |
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atom x y z Biso |
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Ca .7595 .4665 .1470 3.0 |
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V1 .4485 .1020 .3360 3.0 |
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V2 .3750 .5830 .3450 3.0 |
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O1 .3915 .8400 .4170 4.0 |
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O2 .5170 .3920 .3835 4.0 |
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O3 .8610 .7555 .3655 4.0 |
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O4 .1050 .4730 .3345 4.0 |
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O5 .1930 .0635 .2350 4.0 |
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O6 .6245 .1170 .1870 4.0 |
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O7 .4300 .6000 .1460 4.0 |
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O8 .0070 .7210 .0130 4.0 |
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|
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|
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Metahewettite |
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Bachmann H G, Barnes W H |
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The Canadian Mineralogist 7 (1962) 219-235 |
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The crystal structure of a sodium-calcium variety of metahewettite |
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Sample: anhydrous |
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Locality: Paradox Valley, Montrose County, Coldrado,USA |
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_database_code_amcsd 0005078 |
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12.28 3.60 8.00 90 96.25 90 P2_1/m |
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atom x y z Biso |
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V1 .072 .25 .169 3.0 |
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V2 .830 .25 .130 3.0 |
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V3 .523 .25 .830 3.0 |
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Na .310 .25 .432 3.0 |
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O1 .917 .25 .902 3.0 |
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O2 .165 .25 .938 3.0 |
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O3 .471 .25 .094 3.0 |
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O4 .957 .25 .265 3.0 |
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O5 .210 .25 .191 3.0 |
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O6 .705 .25 .152 3.0 |
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O7 .659 .25 .789 3.0 |
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O8 .396 .25 .793 3.0 |
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|
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|
| |
|
Metahewettite |
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Bachmann H G, Barnes W H |
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The Canadian Mineralogist 7 (1962) 219-235 |
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The crystal structure of a sodium-calcium variety of metahewettite |
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Sample: hydrated |
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Locality: Paradox Valley, Montrose County, Coldrado,USA |
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_database_code_amcsd 0005079 |
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12.26 3.58 8.11 90 92.5 90 P2_1 |
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atom x y z occ Biso |
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V1 .067 .25 .170 3.0 |
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V2 .822 .25 .127 3.0 |
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V3 .540 .25 .830 3.0 |
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Na .303 .25 .440 .5 3.0 |
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Ca .303 .25 .440 .25 3.0 |
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O1 .907 .25 .869 3.0 |
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O2 .140 .25 .892 3.0 |
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O3 .475 .25 .115 3.0 |
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O4 .956 .25 .282 3.0 |
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O5 .214 .25 .173 3.0 |
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O6 .682 .25 .045 3.0 |
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O7 .651 .25 .725 3.0 |
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O8 .436 .25 .670 3.0 |
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Wat .708 .25 .360 3.0 |
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|
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|
| |
|
Barnesite |
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Bachmann H G, Barnes W H |
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The Canadian Mineralogist 7 (1962) 219-235 |
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The crystal structure of a sodium-calcium variety of metahewettite |
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Sample: hydrated |
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Note: sample is half-way between barnesite and metahewittite |
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Locality: Paradox Valley, Montrose County, Coldrado,USA |
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_database_code_amcsd 0018488 |
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12.26 3.58 8.11 90 92.5 90 P2_1 |
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atom x y z occ Biso |
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V1 .067 .25 .170 3.0 |
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V2 .822 .25 .127 3.0 |
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V3 .540 .25 .830 3.0 |
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Na .303 .25 .440 .5 3.0 |
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Ca .303 .25 .440 .25 3.0 |
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O1 .907 .25 .869 3.0 |
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O2 .140 .25 .892 3.0 |
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O3 .475 .25 .115 3.0 |
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O4 .956 .25 .282 3.0 |
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O5 .214 .25 .173 3.0 |
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O6 .682 .25 .045 3.0 |
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O7 .651 .25 .725 3.0 |
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O8 .436 .25 .670 3.0 |
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Wat .708 .25 .360 3.0 |
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|
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|
| |
|
Conichalcite |
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Qurashi M M, Barnes W H |
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The Canadian Mineralogist 7 (1963) 561-577 |
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The structures of the minerals of the descloizite and adelite groups: |
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IV - descloizite and conichalcite (part 2) The structure of conichalcite |
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_database_code_amcsd 0005080 |
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7.40 5.84 9.21 90 90 90 P2_12_12_1 |
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atom x y z Biso |
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Ca .116 .269 .425 .2 |
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Cu 0 0 .75 .95 |
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As .368 -.233 .580 .74 |
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O1 .187 -.256 .700 1.0 |
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O2 .538 -.176 .694 1.0 |
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O3 .378 .509 .489 1.0 |
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O4 .368 -.016 .474 1.0 |
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OH5 .151 .250 .680 1.0 |
|
|
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|
| |
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Rossite |
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Ahmed F R, Barnes W H |
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The Canadian Mineralogist 7 (1963) 713-726 |
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The crystal structure of rossite |
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_database_code_amcsd 0005081 |
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8.534 8.556 7.015 101.53 114.97 103.38 P-1 |
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atom x y z Biso |
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Ca .8390 .1503 .9927 .80 |
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V1 .4358 .3328 .8002 .72 |
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V2 .3783 .3366 .2756 .72 |
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O1 .4720 .4142 .0992 .670 |
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O2 .4967 .3835 .5833 .97 |
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O3 .8042 .2731 .6976 1.79 |
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O4 .1625 .3207 .1785 1.43 |
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O5 .2119 .2315 .6576 1.67 |
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O6 .5357 .1903 .8434 1.43 |
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O7 .3741 .1385 .1984 1.28 |
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O8 .9848 .0108 .7775 1.28 |
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O9 .7195 .1162 .2533 1.67 |
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O10 .8948 .4398 .2072 3.28 |
|
|
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|
| |
|
Descloizite |
|
Qurashi M M, Barnes W H |
|
The Canadian Mineralogist 8 (1964) 23-39 |
|
The structures of the minerals of the descloizite and adelite groups: |
|
V - descloizite and conichalcite (part 3). The structure of descloizite |
|
_database_code_amcsd 0005082 |
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7.60 6.07 9.44 90 90 90 P2_12_12_1 |
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atom x y z Biso |
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Pb .128 .253 .426 1.5 |
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Zn 0 .003 .75 1.5 |
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V .367 -.246 .565 1.5 |
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O1 .196 -.265 .670 1.5 |
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O2 .540 -.226 .668 1.5 |
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O3 .380 .516 .456 1.5 |
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O4 .379 -.013 .447 1.5 |
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OH5 .142 .260 .691 1.5 |
|
|
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|
| |
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