American Mineralogist Crystal Structure Database

5 matching records for this search.

Phoenicochroite
Download hom/phoenicochroite.pdf
Williams S A, McLean W J, Anthony J W
Download am/vol55/AM55_784.pdf
American Mineralogist 55 (1970) 784-792
A study of phoenicochroite - its structure and properties
_database_code_amcsd 0000204
14.001 5.675 7.137 90 115.22 90 C2/m
atom     x     y     z Biso
Pb1  .4794     0 .2328  .82
Pb2  .3569    .5 .3870  .94
Cr   .1693     0 .1593  .97
O1   .0930     0 .8984  2.8
O2   .2989     0 .2005  1.4
O3   .1448 .2345 .2662  2.6
O4      .5 .2413    .5  2.0
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Hemihedrite
Download hom/hemihedrite.pdf
McLean W J, Anthony J W
Download am/vol55/AM55_1103.pdf
American Mineralogist 55 (1970) 1103-1114
The crystal structure of hemihedrite
_database_code_amcsd 0000205
9.497 11.443 10.841 120.50 92.10 55.83 P-1
atom     x     y     z Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
Pb1  .2591 .1116 .2594       .0060  .0051  .0040 -.0031 -.0009  .0016
Pb2  .2616 .0862 .6568       .0043  .0039  .0039 -.0021 -.0007  .0019
Pb3  .9306 .2442 .0306       .0052  .0045  .0041 -.0028 -.0010  .0022
Pb4  .7307 .4165 .7513       .0078  .0070  .0058 -.0045 -.0028  .0044
Pb5  .3171 .4530 .5316       .0072  .0071  .0048 -.0052 -.0030  .0040
Zn       0    .5     0       .0051  .0047  .0036 -.0031 -.0015  .0024
Cr1  .9591 .0752 .3555       .0067  .0053  .0045 -.0042 -.0017  .0026
Cr2  .5642 .1758 .1535       .0047  .0047  .0040 -.0023 -.0012  .0028
Cr3  .4470 .3246 .8369       .0041  .0041  .0040 -.0022 -.0008  .0019
Si   .0229 .4516 .6594       .0033  .0010  .0010 -.0008  .0001  .0004
O1   .7535 .2193 .4835 2.12
O2   .1079 .0778 .4436 2.38
O3   .9940 .1184 .7361 1.92
O4   .9677 .1120 .2294 2.36
O5   .5101 .1407 .2712 1.54
O6   .4318 .1992 .0573 2.16
O7   .7772 .0082 .0274 2.06
O8   .5405 .3585 .2686 1.76
O9   .5990 .2969 .9141 1.87
O10  .4559 .3985 .7442 2.45
O11  .2385 .4815 .9767  .97
O12  .4794 .1360 .7183 1.54
O13  .2089 .3053 .5120 1.60
O14  .0421 .3859 .7677 1.20
O15  .9931 .3717 .2568  .92
O16  .8475 .4788 .6134 1.18
F    .1425 .2488 .9318  .87
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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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Connellite
Download hom/connellite.pdf
McLean W J, Anthony J W
Download am/vol57/AM57_426.pdf
American Mineralogist 57 (1972) 426-438
The disordered, "zeolite-like" structure of connellite
_database_code_amcsd 0000275
15.78 15.78 9.10 90 90 120 P-62c
atom     x     y     z  occ Biso
Cu1  .2032     0    .5   .5  1.1
Cu1A .7986     0    .5   .5  1.3
Cu2  .3595 .0149   .25   .5  1.6
Cu2A .3591 .3415   .25   .5  0.8
Cu3  .3349 .1678   .75   .5  1.2
Cu4  .5012     0    .5   .5  1.2
Cu5      0     0     0 .048 1.26
S    .6667 .3333   .25 .133  2.0
Cl1  .2767 .1418   .25   .5  0.9
Cl2   .562  .451   .75 .167  1.8
N    .6667 .3333   .25 .034  2.0
OH1   .451  .077  .092       0.5
OH1A  .450  .366  .088       0.2
OH3   .324  .067  .615       0.0
OH3A  .329  .254  .599       0.9
OH5   .152  .080  .594       1.8
OH7   .562  .451   .75 .333  1.8
O8    .636  .268 .1184 .267  2.5
O9    .622  .396   .25 .133  2.5
O10   .775  .396   .25 .133  2.5
O11   .622  .244   .25 .100  2.5
OH12  .512  .258  .695   .5  5.6
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Yavapaiite
Download hom/yavapaiite.pdf
Anthony J W, McLean W J, Laughon R B
Download am/vol57/AM57_1546.pdf
American Mineralogist 57 (1972) 1546-1549
The crystal structure of yavapaiite: A discussion
_database_code_amcsd 0000295
8.150 5.162 7.855 90 94.87 90 C2/m
atom     x     y     z Biso
Fe       0     0     0  .45
K        0     0    .5 1.50
S    .3700     0 .2020  .47
O1   .2369     0 .0628  .89
O2   .3124     0 .3700 1.49
O3   .4741 .2330 .1810 1.08
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Total number of retrieved datasets: 5
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