|
Arsenopyrite |
 |
Morimoto N, Clark L A |
 |
American Mineralogist 46 (1961) 1448-1469 |
|
Arsenopyrite crystal-chemical relations |
|
From Freiberg, Germany |
|
_database_code_amcsd 0000112 |
|
5.744 5.675 5.785 90.0 112.28 90.0 P-1 |
|
atom x y z |
|
Fe1 .272 0 .289 |
|
Fe2 .275 .502 .787 |
|
As1 .154 .371 .363 |
|
As2 .155 .129 .863 |
|
S1 .346 -.370 .175 |
|
S2 .343 -.131 .675 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Arsenoclasite |
 |
Moore P B, Molin-Case J |
 |
American Mineralogist 56 (1971) 1539-1552 |
|
Crystal chemistry of the basic manganese arsenates: V. Mixed manganese |
|
coordination in the atomic arrangement of arsenoclasite |
|
_database_code_amcsd 0000259 |
|
18.29 5.75 9.31 90 90 90 P2_12_12_1 |
|
atom x y z Biso |
|
Mn1 .4323 .2697 .7522 .65 |
|
Mn2 .0303 .0544 .8886 .61 |
|
Mn3 .2214 .0712 .8582 .59 |
|
Mn4 .1241 .5587 .8796 .76 |
|
Mn5 .3164 .5804 .0009 .71 |
|
As1 .3744 .1117 .0719 .08 |
|
As2 .1243 .1928 .1838 .01 |
|
OH1 .0519 .7350 .0215 .98 |
|
OH2 .2025 .3844 .7397 .96 |
|
OH3 .0412 .3676 .7569 .90 |
|
OH4 .2171 .7461 -.0282 .90 |
|
O5 .1461 .4441 .2643 .62 |
|
O6 .1279 .2324 .0012 1.04 |
|
O7 .1762 -.0277 .2332 .87 |
|
O8 .0380 .0980 .2282 1.00 |
|
O9 .3755 .1103 .2508 .95 |
|
O10 .2934 .2187 .0206 .69 |
|
O11 .4342 .3007 -.0004 .87 |
|
O12 .3916 .8448 .0155 1.07 |
|
|
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  |
|
Arsenosulvanite |
 |
Spry P G, Merlino S, Wang S, Zhang X, Buseck P R |
 |
American Mineralogist 79 (1994) 750-762 |
|
New occurrences and refined crystal chemistry of colusite, with comparisons to |
|
arsenosulvanite |
|
Sample: Sn-poor, crystal 1 |
|
_database_code_amcsd 0001672 |
|
10.538 10.538 10.538 90 90 90 P-43n |
|
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
V 0 0 0 .0079 .0079 .0079 0 0 0 |
|
Cu1 .2592 0 0 .0136 .0228 .0191 0 0 -.0047 |
|
Cu2 .2513 .2513 .2513 .735 .0194 .0194 .0194 .0012 .0012 .0012 |
|
Cu3 .25 0 .5 .0262 .0269 .0269 0 0 0 |
|
As .25 .5 0 .0064 .0077 .0077 0 0 0 |
|
S1 .1209 .1209 .1209 .0088 .0088 .0088 -.0004 -.0004 -.0004 |
|
S2 .3655 .3742 .1208 .0286 .0090 .0144 .0065 -.0065 -.0008 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Arsenohauchecornite |
 |
Grice J D, Ferguson R B |
 |
The Canadian Mineralogist 27 (1989) 137-142 |
|
The crystal structure of arsenohauchecornite |
|
Locality: Vermilion mine, Sudbury District, Ontario, Canada |
|
_database_code_amcsd 0005222 |
|
10.2711 10.2711 10.8070 90 90 90 I4/mmm |
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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) |
|
Ni1 .5 0 0 .0078 .0078 .0094 0 0 0 |
|
Ni2 .14501 .14501 .37922 .0101 .0101 .0081 .0007 -.0004 -.0004 |
|
Ni3 .17109 .17109 .12524 .0088 .0088 .0087 .0014 .0014 .0014 |
|
Bi1 .5 0 .25 .0089 .0089 .0079 0 0 0 |
|
Bi2 0 0 0 .0098 .0098 .0102 0 0 0 |
|
As 0 0 .5 .0063 .0063 .0099 0 0 0 |
|
S1 .3493 .1613 0 .0052 .0057 .0076 .0009 0 0 |
|
S2 .2287 0 .2415 .0084 .0069 .0085 0 .0008 0 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Arseniopleite |
 |
Tait K T, Hawthorne F C |
 |
The Canadian Mineralogist 41 (2003) 71-77 |
|
Refinement of the crystal structure of arseniopleite: Confirmation of its status |
|
as a valid species |
|
_database_code_amcsd 0005825 |
|
6.8113 13.0358 11.3245 90 100.25 90 I2/a |
|
atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
CaX1 .0217 .00131 .51196 .34 .0127 |
|
NaX1 .0217 .00131 .51196 .16 .0127 |
|
NaX2 1/4 .01816 0 .93 .0267 .0187 .0447 .0176 0 .0055 0 |
|
PbX2 1/4 .01816 0 .06 .0267 .0187 .0447 .0176 0 .0055 0 |
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BaX2 1/4 .01816 0 .01 .0267 .0187 .0447 .0176 0 .0055 0 |
|
MnM1 1/4 .73506 0 .01148 .0108 .0119 .0114 0 .00108 0 |
|
MnM2 .08846 .15590 .21656 .605 .01132 .0095 .0130 .0115 -.00058 .00176 .00017 |
|
MgM2 .08846 .15590 .21656 .260 .01132 .0095 .0130 .0115 .00058 .00176 .00017 |
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FeM2 .08846 .15590 .21656 .135 .01132 .0095 .0130 .0115 .00058 .00176 .00017 |
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As1 1/4 .28829 0 .01037 .01044 .00991 .01185 0 .00496 0 |
|
As2 .10766 .88811 .23133 .00967 .00892 .01111 .00956 .00053 .00322 .00024 |
|
O1 .0669 .21526 .03833 .0148 .011 .0196 .0148 -.0025 .0044 .0018 |
|
O2 .1481 .12546 .39581 .0245 .0408 .0166 .0179 -.0145 .0099 -.0052 |
|
O3 .2771 .83036 .16070 .0143 .0110 .0175 .0157 .0007 .0061 -.0032 |
|
O4 .1963 .90301 .37980 .0150 .0192 .0148 .0104 .0016 .0011 -.0008 |
|
O5 .1019 .31791 .28168 .0153 .0096 .0191 .0174 .0025 .0032 .0013 |
|
O6 .0552 .00113 .16087 .0160 .0189 .0135 .0156 .0036 .0030 .0039 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Arsenopyrite |
 |
Bindi L, Moelo Y, Leone P, Suchaud M |
|
The Canadian Mineralogist 50 (2012) 471-479 |
|
Stoichiometric arsenopyrite, FeAsS, from La Roche-Balue Quarry, |
|
Loire-Atlantique, France: Crystal structure and Mossbauer study |
|
Locality: La Roche-Balue Quarry, Loire-Atlantique, France |
|
_database_code_amcsd 0019195 |
|
5.7612 5.6841 5.7674 90 111.721 90 P2_1/c |
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atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Fe .28353 -.00643 .29429 .0155 .0155 .0152 .0159 .0004 .0059 .0003 |
|
As .14746 .13055 .86937 .0159 .0158 .0158 .0162 .0002 .0060 -.0002 |
|
S .6551 .1311 .3211 .0188 .0177 .0188 .0201 -.0004 .0072 .0001 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Arsenoflorencite-(La) |
|
Mills S J, Kartashov P M, Kampf A R, Raudsepp M |
|
European Journal of Mineralogy 22 (2010) 613-621 |
|
Arsenoflorencite-(La), a new mineral from the Komi Republic, Russian Federation: |
|
description and crystal structure |
|
Locality: Grubependity Lake cirque, Prepolar Ural, Komi Republic, Russia |
|
_database_code_amcsd 0017090 |
|
7.0316 7.0316 16.5151 90 90 120 R-3m |
|
atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
La 0 0 0 .00728 .00815 .00815 .00555 .00408 0 0 |
|
Al .5 0 .5 .0055 .0057 .0044 .0060 .0022 .00004 .0001 |
|
As 0 0 .31492 .00478 .00472 .00472 .00488 .00236 0 0 |
|
O1 0 0 .58543 .0113 .0117 .0117 .0105 .0059 0 0 |
|
O2 .20482 -.20482 -.05460 .0100 .0117 .0117 .0090 .0078 .0005 .0005 |
|
O3 .12273 -.12273 .13701 .0084 .0071 .0071 .0113 .0037 .0008 .0008 |
|
H .194 -.194 .122 .048 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Arsenstruvite |
|
Ferraris G, Franchini-Angela M |
 |
Acta Crystallographica B29 (1973) 859-863 |
|
Hydrogen bonding in the crystalline state. Refinement of the crystal structure |
|
of MgNH4AsO4*6(H2O), arsenstruvite |
|
Locality: synthetic |
|
_database_code_amcsd 0009477 |
|
7.054 6.205 11.368 90 90 90 Pmn2_1 |
|
atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
|
As 0 -.00588 -.00050 .006029 .00655 .00218 0 0 -.00010 |
|
Mg 0 .3733 .3717 .006431 .00811 .00259 0 0 -.00010 |
|
O1 0 -.0236 -.1490 .012711 .01519 .00247 0 0 -.00031 |
|
O2 0 -.2563 .0574 .009154 .00727 .00356 0 0 .00085 |
|
O3 .1972 .1234 .0444 .007938 .01201 .00356 -.00097 -.00012 -.00138 |
|
OW1 0 .6762 .2889 .024669 .01181 .00328 0 0 .00152 |
|
OW1 0 .0757 .4597 .006632 .01857 .00920 0 0 .00786 |
|
OW3 .2165 .2663 .2625 .011556 .01818 .00296 .00308 -.00024 -.00141 |
|
OW4 .2062 .4789 .4863 .012561 .01207 .00433 .00028 -.00573 -.00198 |
|
N 0 .3694 .7312 .018640 .01785 .00408 0 0 .00209 |
|
H1 0 .270 .771 1.0 |
|
H2 0 .684 .204 1.3 |
|
H3 0 .799 .318 2.8 |
|
H4 .115 .023 .485 2.1 |
|
H5 .178 .187 .213 4.8 |
|
H6 .236 .637 .506 6.8 |
|
H7 .294 .200 .302 .5 |
|
H8 .315 .380 .529 2.2 |
|
H9 .080 .350 .681 .75 5.0 |
|
H10 .085 .450 .740 .75 5.4 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Arsenopyrite |
 |
Buerger M |
 |
Zeitschrift fur Kristallographie 95 (1936) 83-113 |
|
The symmetry and crystal structure of the minerals of the arsenopyrite group |
|
Locality: St Peter mine, Spindelmuhle, Bohemia |
|
_database_code_amcsd 0016964 |
|
9.51 5.65 6.42 90 90 90.0 B2_1/d |
|
atom x y z |
|
Fe 0 0 .275 |
|
As .147 .128 0 |
|
S .167 .132 .5 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Arsenopyrite |
 |
Fuess H, Kratz T, Topel-Schadt J, Miehe G |
 |
Zeitschrift fur Kristallographie 179 (1987) 335-346 |
|
Crystal structure refinement and electron microscopy of arsenopyrite |
|
Locality: Hakansboda, Sweden |
|
_database_code_amcsd 0010966 |
|
6.5456 9.451 5.6492 90 90 89.84 C2_1/d |
|
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Fe .2769 .0042 .0035 .87 .0126 .0060 .0047 .0006 .0001 -.0007 |
|
Co .2769 .0042 .0035 .13 .0126 .0060 .0047 .0006 .0001 -.0007 |
|
As1 -.0067 .1425 .1286 .69 .0057 .0070 .0038 .0010 -.0001 -.0004 |
|
S1 -.0067 .1425 .1286 .31 .0057 .0070 .0038 .0010 -.0001 -.0004 |
|
S2 .5081 .1638 .1309 .78 .0057 .0081 .0041 .0008 .0002 .0007 |
|
As2 .5081 .1638 .1309 .22 .0057 .0081 .0041 .0008 .0002 .0007 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Arsenopyrite |
 |
Fuess H, Kratz T, Topel-Schadt J, Miehe G |
 |
Zeitschrift fur Kristallographie 179 (1987) 335-346 |
|
Crystal structure refinement and electron microscopy of arsenopyrite |
|
Locality: Hakansboda, Sweden |
|
Note: structure was transformed to this setting from C2_1/d |
|
_database_code_amcsd 0010967 |
|
5.741 5.649 5.756 90 110.588 90 P2_1/c |
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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) |
|
Fe .2727 -.0035 .2811 .87 .00987 .0047 .01105 -.00048 .00657 .00032 |
|
Co .2727 -.0035 .2811 .13 .00987 .0047 .01105 -.00048 .00657 .00032 |
|
As1 -.1492 -.1286 .1358 .69 .00517 .0038 .00708 -.00015 .00158 .00031 |
|
S1 -.1492 -.1286 .1358 .31 .00517 .0038 .00708 -.00015 .00158 .00031 |
|
S2 .3443 -.1309 .6719 .78 .00571 .0041 .00725 .00023 .00123 -.00056 |
|
As2 .3443 -.1309 .6719 .22 .00571 .0041 .00725 .00023 .00123 -.00056 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Arsenolite |
 |
Ballirano P, Maras A |
 |
Zeitschrift fur Kristallographie 217 (2002) 177-178 |
|
Refinement of the crystal structure of arsenolite, As2O3 |
|
Locality: starting material (realgar) from Monte Sughereto, Latium, Italy |
|
_database_code_amcsd 0011094 |
|
11.07343 11.07343 11.07343 90 90 90 *Fd3m |
|
.125 .125 .125 |
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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) |
|
As .77221 .77221 .77221 .0169 .0169 .0169 .0003 .0003 .0003 |
|
O .9524 .125 .125 .027 .020 .020 0 0 .010 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Arsenolamprite |
 |
Wyckoff R W G |
|
Crystal Structures 1 (1963) 239-444 |
|
Second edition. Interscience Publishers, New York, New York |
|
_database_code_amcsd 0011251 |
|
3.63 4.45 10.96 90 90 90 Bmab |
|
atom x y z |
|
As 0 .090 .098 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Arsenic |
 |
Wyckoff R W G |
|
Crystal Structures 1 (1963) 7-83 |
|
Second edition. Interscience Publishers, New York, New York |
|
_database_code_amcsd 0011252 |
|
4.131 4.131 4.131 54.167 54.167 54.167 R-3m |
|
atom x y z |
|
As .226 .226 .226 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Arsenolite |
 |
Pertlik F |
  |
Czechoslovak Journal of Physics B28 (1978) 170-176 |
|
Structure refinement of cubic As2O3 (arsenolithe) with single crystal data |
|
_database_code_amcsd 0012423 |
|
11.074 11.074 11.074 90 90 90 Fd-3m |
|
atom x y z B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
|
As .8971 .8971 .8971 .0043 .0043 .0043 -.00026 -.00026 -.00026 |
|
O .1726 0 0 .0052 .0061 .0061 0 0 -.0002 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Arsenic |
 |
Schiferl D, Barrett CS |
  |
Journal of Applied Crystallography 2 (1969) 30-36 |
|
The crystal structure of arsenic at 4.2, 78 and 299 K |
|
Sample: T = 4.2 K |
|
_database_code_amcsd 0012833 |
|
3.7597 3.7597 10.4412 90 90 120 R-3m |
|
atom x y z Biso |
|
As 0 0 .22764 .229 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Arsenic |
 |
Schiferl D, Barrett CS |
  |
Journal of Applied Crystallography 2 (1969) 30-36 |
|
The crystal structure of arsenic at 4.2, 78 and 299 K |
|
Sample: T = 78 K |
|
_database_code_amcsd 0012834 |
|
3.7595 3.7595 10.4573 90 90 120 R-3m |
|
atom x y z Biso |
|
As 0 0 .22754 .321 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Arsenic |
 |
Schiferl D, Barrett CS |
  |
Journal of Applied Crystallography 2 (1969) 30-36 |
|
The crystal structure of arsenic at 4.2, 78 and 299 K |
|
Sample: T = 299 K |
|
_database_code_amcsd 0012835 |
|
3.7598 3.7598 10.5475 90 90 120 R-3m |
|
atom x y z Biso |
|
As 0 0 .22707 .835 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Arsenolite |
 |
Bozorth R M |
  |
Journal of the American Chemical Society 45 (1923) 1621-1627 |
|
The crystal structures of the cubic forms of arsenious and antimonous oxides |
|
Note: synthetic sample |
|
_database_code_amcsd 0014074 |
|
11.06 11.06 11.06 90 90 90 Fd-3m |
|
atom x y z |
|
As .895 .895 .895 |
|
O .21 0 0 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Arsenohopeite |
|
Neuhold F, Kolitsch U, Bernhardt H J, Lengauer C L |
|
Mineralogical Magazine 76 (2012) 603-612 |
|
Arsenohopeite, a new zinc arsenate mineral from the Tsumeb mine, Namibia |
|
Locality: Tsumeb, Namibia |
|
_database_code_amcsd 0018914 |
|
10.804 19.003 5.112 90 90 90 Pnma |
|
atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Zn1 .23741 .25 .57469 .82 .01912 .0181 .0218 .0175 0 .0016 0 |
|
Fe1 .23741 .25 .57469 .08 .01912 .0181 .0218 .0175 0 .0016 0 |
|
Mn1 .23741 .25 .57469 .05 .01912 .0181 .0218 .0175 0 .0016 0 |
|
Mg1 .23741 .25 .57469 .05 .01912 .0181 .0218 .0175 0 .0016 0 |
|
Zn2 .14543 -.00046 .20551 .01842 .0175 .0217 .0160 -.00016 .00024 -.00066 |
|
As .10007 .095516 .71834 .01728 .0202 .01588 .01579 .00072 .00112 -.00028 |
|
O4 .1407 .17731 .7895 .0299 .0461 .0187 .0247 -.0117 .0138 -.0050 |
|
O5 .0996 .08142 .3953 .0389 .074 .0271 .0152 .0166 -.0058 -.0048 |
|
O6 .4619 .07907 .6452 .0290 .0194 .0261 .0416 -.0025 -.0045 .0077 |
|
O7 .1986 .03623 .8592 .0226 .0191 .0303 .0184 .0041 .0053 .0058 |
|
OW1 .1072 .25 .2645 .0290 .029 .034 .023 0 -.0035 0 |
|
OW2 .3858 .25 .8494 .0366 .020 .055 .035 0 -.004 0 |
|
OW3 .3354 .17204 .3427 .0375 .036 .0329 .043 .0090 .0028 .0027 |
|
H11 .115 .290 .169 .09 |
|
H21 .462 .25 .795 .06 |
|
H31 .380 .135 .373 .13 |
|
H32 .290 .145 .286 .14 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Arsenoflorencite-(La) |
|
Mills S J, Nestola F |
|
Mineralogical Magazine 76 (2012) 975-985 |
|
Elasticity and high-pressure structure of arsenoflorencite-(La): |
|
insights into the high-pressure behaviour of the alunite supergroup |
|
note: P = 1.6 GPa |
|
Locality: Grupendity Lake cirque, Komi Republic, Russia |
|
_database_code_amcsd 0019918 |
|
7.0147 7.0147 16.4461 90 90 120 R-3m |
|
atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
La 0 0 0 .0138 .0138 .0138 .0137 .0069 0 0 |
|
Al .5 0 .5 .95 .0156 .015 .015 .016 .0073 .0004 .001 |
|
Fe .5 0 .5 .05 .0156 .015 .015 .016 .0073 .0004 .001 |
|
As 0 0 .31550 .93 .0113 .0101 .0101 .0138 .0050 0 0 |
|
P 0 0 .31550 .07 .0113 .0101 .0101 .0138 .0050 0 0 |
|
O1 0 0 .5841 .015 .015 .015 .016 .008 0 0 |
|
O2 .2041 -.2041 -.0556 .010 .009 .009 .017 .008 -.0017 .0017 |
|
OH3 .1238 -.1238 .1382 .0088 .010 .010 .011 .008 .0010 -.0010 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Arsenoflorencite-(La) |
|
Mills S J, Nestola F |
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Mineralogical Magazine 76 (2012) 975-985 |
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Elasticity and high-pressure structure of arsenoflorencite-(La): |
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insights into the high-pressure behaviour of the alunite supergroup |
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note: P = 3.6 GPa |
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Locality: Grupendity Lake cirque, Komi Republic, Russia |
|
_database_code_amcsd 0019919 |
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6.9822 6.9822 16.3379 90 90 120 R-3m |
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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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La 0 0 0 .0140 .0137 .0137 .0146 .0068 0 0 |
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Al .5 0 .5 .95 .0148 .014 .014 .017 .0068 .0020 .004 |
|
Fe .5 0 .5 .05 .0148 .014 .014 .017 .0068 .0020 .004 |
|
As 0 0 .31634 .93 .0112 .0109 .0109 .0119 .0054 0 0 |
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P 0 0 .31634 .07 .0112 .0109 .0109 .0119 .0054 0 0 |
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O1 0 0 .5835 .014 .010 .010 .022 .005 0 0 |
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O2 .2037 -.2037 -.0535 .016 .018 .018 .015 .011 -.002 .002 |
|
OH3 .1250 -.1250 .1381 .0092 .010 .010 .010 .006 .0019 -.0019 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Arsenoflorencite-(La) |
|
Mills S J, Nestola F |
|
Mineralogical Magazine 76 (2012) 975-985 |
|
Elasticity and high-pressure structure of arsenoflorencite-(La): |
|
insights into the high-pressure behaviour of the alunite supergroup |
|
note: P = 5.7 GPa |
|
Locality: Grupendity Lake cirque, Komi Republic, Russia |
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_database_code_amcsd 0019920 |
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6.9538 6.9538 16.2436 90 90 120 R-3m |
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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) |
|
La 0 0 0 .0161 .0163 .0163 .0156 .0082 0 0 |
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Al .5 0 .5 .95 .0157 .018 .018 .011 .0091 .0011 .002 |
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Fe .5 0 .5 .05 .0157 .018 .018 .011 .0091 .0011 .002 |
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As 0 0 .31695 .93 .0133 .0130 .0130 .0141 .0065 0 0 |
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P 0 0 .31695 .07 .0133 .0130 .0130 .0141 .0065 0 0 |
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O1 0 0 .5827 .018 .006 .006 .044 .003 0 0 |
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O2 .2039 -.2039 -.0518 .016 .020 .020 .012 .013 -.003 .003 |
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OH3 .1261 -.1261 .1386 .0096 .013 .013 .007 0 .0007 -.0007 |
|
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| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Arsenoflorencite-(La) |
|
Mills S J, Nestola F |
|
Mineralogical Magazine 76 (2012) 975-985 |
|
Elasticity and high-pressure structure of arsenoflorencite-(La): |
|
insights into the high-pressure behaviour of the alunite supergroup |
|
note: P = 7.4 GPa |
|
Locality: Grupendity Lake cirque, Komi Republic, Russia |
|
_database_code_amcsd 0019921 |
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6.9280 6.9280 16.1770 90 90 120 R-3m |
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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) |
|
La 0 0 0 .028 .041 .041 .003 .0203 0 0 |
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Al .5 0 .5 .95 .024 .040 .025 .002 .013 -.002 -.004 |
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Fe .5 0 .5 .05 .024 .040 .025 .002 .013 -.002 -.004 |
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As 0 0 .3169 .93 .024 .031 .031 .010 .0155 0 0 |
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P 0 0 .3169 .07 .024 .031 .031 .010 .0155 0 0 |
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O1 0 0 .579 .032 |
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O2 .2074 -.2074 -.054 .032 |
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OH3 .1280 -.1280 .1403 .018 |
|
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| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
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Arsenopalladinite |
 |
Karimova O V, Zolotarev A A, Johanson B S, Evstigneeva T L |
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Mineralogical Magazine 84 (2020) 746-752 |
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The crystal structure of arsenopalladinite, Pd8As2.5Sb0.5, |
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and its relation to mertieite-II, Pd8Sb2.5As0.5 |
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Locality: Kaarreoja River, Inari commune, Finnish Lapland, Finland |
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_database_code_amcsd 0020905 |
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7.3344 7.3870 7.5255 98.869 102.566 119.096 P-1 |
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atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Pd1 .4357 .05665 .15926 .0170 .0176 .0134 .0211 .0080 .0087 .0065 |
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Pd2 .1814 .12257 .39072 .0165 .0139 .0120 .0187 .0054 .0005 .0050 |
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Pd3 .7896 .5003 .3932 .0212 .0156 .0129 .0312 .0034 .0153 .0014 |
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Pd4 .3778 .4168 .15203 .0252 .0330 .0089 .0188 .0059 -.0045 .0053 |
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Pd5 .0506 .7101 -.20324 .0225 .0334 .0311 .0159 .0287 .0044 .0045 |
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Pd6 -.0135 .3095 -.15586 .0226 .0209 .0120 .0189 -.0002 -.0016 .0091 |
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Pd7 .7230 .8474 .20667 .0236 .0103 .0317 .0171 .0028 .0060 .0061 |
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Pd8 .4092 .7740 .3954 .0247 .0281 .0447 .0294 .0314 .0200 .0254 |
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Sb1 0 0 0 .0098 .0108 .0079 .0133 .0054 .0060 .0054 |
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As1 .5 .5 .5 .0124 .0104 .0099 .0164 .0045 .0051 .0057 |
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As2 .1677 .8345 -.4739 .0141 .0161 .0165 .0158 .0114 .0080 .0067 |
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As3 .3345 .6753 .0015 .0137 .0088 .0085 .0237 .0047 .0027 .0084 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Arsentsumebite |
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Zubkova N V, Pushcharovsky D Y, Giester G, Tillmanns E, Pekov I V, Kleimenov D A |
  |
Mineralogy and Petrology 75 (2002) 79-88 |
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The crystal structure of arsentsumebite, Pb2Cu[(As,S)O4]2(OH) |
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Locality: oxidation zone of the Berezovskoye gold deposit, Middle Urals, Russia |
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_database_code_amcsd 0014646 |
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7.804 5.890 8.964 90 112.29 90 P2_1/m |
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atom x y z occ Biso |
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Pb1 .7163 .25 .2412 3.4 |
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Pb2 .2987 .25 .3869 2.8 |
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Cu 0 0 0 1.50 |
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As1 .5584 .25 -.1715 .63 1.0 |
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S1 .5584 .25 -.1715 .37 1.0 |
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As2 -.0449 .25 -.3502 .37 1.2 |
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S2 -.0449 .25 -.3502 .63 1.2 |
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OH1 .1707 .25 .0811 .9 |
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O2 -.2413 .25 -.4682 2.9 |
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O3 .0928 .25 .5563 4.8 |
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O4 .4336 .25 .9346 3.8 |
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O5 .7754 .25 -.0543 2.1 |
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O6 -.0002 .0302 -.2410 2.6 |
|
O7 .5099 .0252 -.2875 2.5 |
|
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| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Arsenotucekite |
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Zaccarini F, Luca Bindi L, Tsikouras B, Grammatikopoulos T, Stanley C J, Garuti G |
  |
Mineralogy and Petrology 114 (2020) 435-442 |
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Arsenotucekite, Ni18Sb3AsS16, a new mineral from the Tsangli chromitites, |
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Othrys ophiolite, Greece |
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Locality: Tsangli chromitites, Othrys ophiolite, Greece |
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_database_code_amcsd 0020942 |
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9.7856 9.7856 10.7582 90 90 90 I4/mmm |
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atom x y z occ Uiso |
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Ni1 0 .5 0 .90 .0394 |
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Co1 0 .5 0 .06 .0394 |
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Fe1 0 .5 0 .04 .0394 |
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Ni2 .14285 .14285 .38158 .90 .0399 |
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Co2 .14285 .14285 .38158 .06 .0399 |
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Fe2 .14285 .14285 .38158 .04 .0399 |
|
Ni3 .17361 .17361 .13537 .90 .0538 |
|
Co3 .17361 .17361 .13537 .06 .0538 |
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Fe3 .17361 .17361 .13537 .04 .0538 |
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Sb1 0 .5 .25 .0426 |
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Sb2 0 0 0 .0400 |
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As 0 0 .5 .65 .0327 |
|
Sb 0 0 .5 .35 .0327 |
|
S1 .3447 .1711 0 .0652 |
|
S2 0 .2440 .2507 .0603 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Arsendescloizite |
 |
Keller P, Lissner F, Schleid T |
  |
Neues Jahrbuch fur Mineralogie, Monatshefte 2003 (2003) 374-384 |
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The crystal structure of arsendescloizite, PbZn(OH)[AsO4], from Tsumeb (Namibia) |
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Locality: Tsumeb, Namibia |
|
_database_code_amcsd 0014924 |
|
7.646 9.363 6.077 90 90 90 P2_12_12_1 |
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atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Pb .36712 .17148 .02753 .0161 .0135 .0141 .0206 -.0001 .0003 .0008 |
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Zn .23436 .50774 .23869 .0161 .0176 .0192 .0116 -.0030 .0023 -.0007 |
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As .38125 .81220 -.01024 .0101 .0089 .0106 .0108 -.0002 .0005 -.0007 |
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O1 .4425 .4220 .4932 .015 .011 .018 .015 .001 .004 .003 |
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O2 .2945 .0830 .4475 .020 .014 .016 .029 .003 .001 .003 |
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O3 .1363 .2812 .7304 .018 .018 .021 .015 -.002 -.001 -.005 |
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O4 .6081 .2039 .7352 .013 .014 .012 .013 -.001 .001 .002 |
|
O5 .1112 .5654 .5057 .010 .015 .007 .008 -.002 .001 .002 |
|
H .018 .492 .490 .134 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Arsenolamprite |
 |
Smith P M, Leadbetter A J, Apling A J |
  |
Philosophical Magazine 31 (1974) 57-64 |
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The structures of orthorhombic and vitrous arsenic |
|
Locality: synthetic |
|
Note: known as arsenolamprite |
|
_database_code_amcsd 0014996 |
|
3.65 4.47 11.00 90 90 90 Bmab |
|
atom x y z Biso |
|
As 0 .060 .110 .9 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Arsenbrackebuschite |
 |
Hofmeister W, Tillmanns E |
  |
Tschermaks Mineralogische und Petrographische Mitteilungen 25 (1978) 153-163 |
|
Strukturelle untersuchungen an arsenbrackebuschit |
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Locality: Tsumeb, Namibia |
|
_database_code_amcsd 0015672 |
|
7.763 6.046 9.022 90 112.5 90 P2_1/m |
|
atom x y z occ |
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Pb1 .2739 .75 .7356 |
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Pb2 .6960 .75 .6023 |
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Fe3+ 0 0 0 .65 |
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Zn2+ 0 0 0 .35 |
|
As1 .4357 .75 .1736 |
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As2 .0322 .75 .3367 |
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O1 .996 .983 .225 |
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O2 .262 .75 .471 |
|
O3 .898 .75 .444 |
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O4 .492 .977 .291 |
|
O5 .541 .75 .041 |
|
O6 .199 .75 .062 |
|
OH7 .821 .75 .916 .65 |
|
Wat7 .821 .75 .916 .35 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
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