American Mineralogist Crystal Structure Database

8 matching records for this search.

Carminite
Download hom/carminite.pdf
Finney J J
Download am/vol48/AM48_1.pdf
American Mineralogist 48 (1963) 1-13
The crystal structure of carminite
_database_code_amcsd 0000118
16.595 7.580 12.295 90 90 90 Cccm
atom     x      y     z Biso
Pb1      0      0   .25  .71
Pb2    .25    .75     0  .36
As1  .0427  .7403     0 1.68
As2  .2111      0   .25  .70
Fe   .3778  .1309 .1360  .40
O1   .0182  .2404 .1153  .92
O2   .0949  .5317     0 2.24
O3   .1136 -.1055     0
O4   .1525  .1741 .2411  .79
O5   .2721 -.0129 .1450  .58
OH1  .1656  .2589     0
OH2  .4303      0   .25  .90
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Cheralite
Download hom/cheralite.pdf
Finney J J, Rao N N
Download am/vol52/AM52_13.pdf
American Mineralogist 52 (1967) 13-19
The crystal structure of cheralite
_database_code_amcsd 0000152
6.717 6.920 6.434 90 103.83 90 P2_1/n
atom     x     y      z  occ Biso
Ce   .2198 .1596  .3991  .15 1.08
La   .2198 .1596  .3991  .14 1.08
Th   .2198 .1596  .3991  .33 1.08
Ca   .2198 .1596  .3991  .32 1.08
Pb   .2198 .1596  .3991  .01 1.08
U    .2198 .1596  .3991  .05 1.08
P    .1960 .1630  .8858  .96  .83
Si   .1960 .1630  .8858  .04  .83
O1   .2473 .5064  .4426      2.56
O2   .0238 .1044  .6906      1.84
O3   .3740 .2221  .7898      1.56
O4   .1114 .3337 -.0011      1.93
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Augelite
Download hom/augelite.pdf
Araki T, Finney J J, Zoltai T
Download am/vol53/AM53_1096.pdf
American Mineralogist 53 (1968) 1096-1103
The crystal structure of augelite
_database_code_amcsd 0000177
13.124 7.988 5.066 90 112.25 90 C2/m
atom     x     y     z B(1,1) B(2,2) B(3,3)  B(1,2) B(1,3)  B(2,3)
Al1      0 .1989     0 .00095 .00136 .00574       0 .00144       0
Al2  .1889     0 .9792 .00074 .00186 .00238       0 .00064       0
P    .3528     0 .6278 .00056 .00126 .00108       0 .00041       0
O1   .2576     0 .7322 .00137 .00464 .00627       0 .00173       0
O2   .3038     0 .3003 .00126 .01027 .00267       0 .00078       0
O3   .4215 .1563 .7170 .00280 .00469 .02054 -.00230 .00510 -.00650
OH1  .0853     0 .1980 .00126 .00284 .00367       0 .00057       0
OH2  .1071 .1813 .8431 .00163 .00273 .01080 0.00051 .00266 0.00145
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Howlite
Download hom/howlite.pdf
Finney J J, Kumbasar I, Konnert J A, Clark J R
Download am/vol55/AM55_716.pdf
American Mineralogist 55 (1970) 716-728
Crystal structure of the calcium silicoborate, howlite
_database_code_amcsd 0000202
12.78 9.33 8.60 90 104.83 90 P2_1/c
atom     x     y     z Biso
Ca1  .1171 .1838 .1493   .8
Ca2  .4118 .8216 .5228   .7
Si   .1411 .5549 .0115   .7
B1    .039  .471  .257  1.2
B2    .323  .384  .033  1.0
B3    .492  .423  .256  1.4
B4    .343  .261  .284  1.1
B5    .157  .650  .476  1.3
O1    .081  .512 -.174   .9
O2    .127  .723  .047  1.4
O3    .102  .450  .137   .8
O4    .269  .525  .030   .9
O5    .061  .597  .355   .5
O6    .438  .407  .078  1.1
O7    .292  .171  .364   .8
O8    .287  .282  .130  1.0
O9    .438  .333  .352   .8
OH10  .497  .570  .294  1.1
OH11  .601  .356  .272   .9
OH12  .246  .685  .398  1.0
OH13  .197  .542  .599   .8
OH14  .055  .338  .351   .5
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Legrandite
Download hom/legrandite.pdf
McLean W J, Anthony J W, Finney J J, Laughon R B
Download am/vol56/AM56_1147.pdf
American Mineralogist 56 (1971) 1147-1154
The crystal structure of legrandite
_database_code_amcsd 0000249
12.805 7.933 10.215 90 104.388 90 P2_1/c
atom     x     y     z  B(1,1)  B(2,2)   B(3,3)   B(1,2)   B(1,3)   B(2,3)
As1  .1499 .0548 .2202 .000829 .001470  .000817 -.000076 -.000020  .000191
As2  .3853 .4221 .2140 .000829 .001510  .000766  .000102  .000102 -.000350
Zn1  .4031 .0500 .3896 .001430 .003416  .001813 -.000076 -.000122  .000064
Zn2  .2529 .3314 .4625 .001024 .003377  .002043 -.000178  .000081 -.000191
Zn3  .3620 .8063 .1282 .001706 .001986  .001992  .000102 -.000102  .000573
Zn4  .0100 .2417 .4408 .001479 .004846  .002502 -.000025  .000428 -.000223
O1    .269  .955  .260 .002048 .003218  .001685  .001347 -.000183 -.000924
O2    .140  .159  .073 .001349 .003297  .000715  .000965 -.000774 -.000637
O3    .133  .188  .340 .000211 .009375  .001787 -.000991  .000000 -.000924
O4    .050  .913  .200 .002519 .003575  .002298 -.002185  .000978 -.002007
O5    .479  .950  .241 .001625 .003337  .002196 -.000864  .000815 -.002612
O6    .352  .344  .057 .003543 .004211 -.000562 -.000584  .000957 -.002484
O7    .344  .290  .320 .001609 .001708  .001583 -.000432  .001589  .004077
O8    .320  .608  .218 .002178 .003655  .002017  .001042  .000550  .000701
O9    .081  .534  .143 .003071 .006555  .006052 -.000407  .000957  .003026
O10   .448  .663  .014 .001381 .003774  .001634  .001194  .000265 -.000159
O11   .275  .578  .468 .003153 .006952  .001226  .000152  .001446 -.000733
O12   .089  .731  .435 .002698 .010090  .005439  .000381  .000407  .000064
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Euchroite
Download hom/euchroite.pdf
Finney J J
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0365-110X&volume=21&spage=437
Acta Crystallographica 21 (1966) 437-440
Refinement of the crystal structure of euchroite, Cu2(AsO4)(OH)*3H2O
_database_code_amcsd 0009302
10.063 10.522 6.107 90 90 90 P2_12_12_1
atom     x     y     z Biso
Cu1  .2431 .0082 .9698  .83
Cu2  .1993 .2488 .6660  .90
As   .3910 .2358 .2172  .64
Wat1 .7838 .0862 .3710  .64
Wat2 .0660 .3107 .2790 1.86
O3   .0461 .3183 .8232  .22
O4   .3058 .1860     0 1.69
O5   .3250 .1665 .4584 1.08
O6   .0713 .0511 .2234  .62
Wat7 .1445 .0676 .7160  .58
OH8  .3927 .3883 .2485  .64
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Chloroxiphite
Download hom/chloroxiphite.pdf
Finney J J, Graeber E J, Rosenzweig A, Hamilton R D
Download mm/vol41/MM41_357.pdf
Mineralogical Magazine 41 (1977) 357-361
The structure of chloroxiphite, Pb3CuO2(OH)2Cl2
Locality: Mendip Hills, Somerset, England
_database_code_amcsd 0014466
10.458 5.750 6.693 90 97.79 90 P2_1/m
atom     x   y     z Biso
Pb1  .2167 .25 .4606 1.43
Pb2  .5502 .25 .3432 1.34
Pb3  .6741 .25 .8673 1.35
Cu       0   0     0 1.61
O1    .366 .00  .386 1.32
OH1   .907 .25  .832 1.37
OH2   .126 .25  .086 1.72
Cl1   .378 .25  .868 1.68
Cl2   .886 .25  .321 2.44
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Junitoite
Download hom/junitoite.pdf
Hamilton R D, Finney J J
Download mm/vol49/MM49_91.pdf
Mineralogical Magazine 49 (1985) 91-95
The structure of junitoite, CaZn2Si2O7*H2O
Locality: Christmas mine, Gile County, Arizona, USA
_database_code_amcsd 0014480
12.510 6.318 8.561 90 90 90 Ama2
atom     x     y     z Biso
Ca     1/4 .2462 .1119  .40
Zn1      0     0 .0000 1.23
Zn2      0     0 .4963  .15
Si   .1316 .7348 .2359  .32
O1   .0437 .7438 .3764  .72
O2   .1213 .5314 .1360 1.10
O3   .1263 .9517 .1249 1.21
O4     1/4 .7721 .3270  .46
Wat    1/4 .2746 .3785 3.22
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Total number of retrieved datasets: 8
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