American Mineralogist Crystal Structure Database

22 matching records for this search.

Hallimondite
Download hom/hallimondite.pdf
Locock A J, Burns P C, Flynn T M
Download am/vol90/AM90_240.pdf
American Mineralogist 90 (2005) 240-246
The role of water in the structures of synthetic hallimondite, Pb2[(UO2)(AsO4)2](H2O)n
and synthetic parsonsite, Pb2[(UO2)(PO4)2](H2O)n, 0 < n < 0.5
_database_code_amcsd 0003720
7.1153 10.4780 6.8571 101.178 95.711 86.651 P-1
atom      x     y     z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
U1    .6186 .8400 .0988     .010   .016   .007   .008   .001   .003   .001
Pb1   .3090 .5416 .2785     .016   .018   .019   .012  -.001   .003   .002
Pb2   .0451 .7776 .7170     .018   .021   .012   .022   .001   .006   .000
As1   .5365 .8167 .6206     .009   .013   .007   .007   .000   .002   .000
As2   .8238 .5494 .2763     .010   .011   .009   .009   .001   .001   .002
O1    .0022 .6340 .4155     .018   .012   .022   .018  -.005  -.002   .000
O2    .3486 .4738 .5851     .014   .013   .019   .013   .000   .005   .007
O3    .3859 .7840 .0731     .021   .019   .025   .019  -.004   .002   .005
O4    .6811 .7288 .7623     .015   .022   .015   .007   .003   .000   .002
O5    .7149 .6298 .1057     .020   .034   .011   .013   .006  -.001   .004
O6    .3323 .7477 .5346     .017   .014   .017   .017  -.004   .002  -.003
O7    .5018 .0540 .1927     .019   .040   .009   .008   .008   .002   .001
O8    .8504 .8978 .1144     .021   .022   .022   .021  -.009   .005   .002
O9    .6524 .8562 .4429     .019   .022   .023   .013  -.002   .004   .005
O10   .9230 .4099 .1582     .021   .029   .014   .019   .009   .009   .002
Wat11 .0500 .9720 .4740 .29 .073
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View JMOL 3-D Structure (permalink)
 
Parsonsite
Download hom/parsonsite.pdf
Locock A J, Burns P C, Flynn T M
Download am/vol90/AM90_240.pdf
American Mineralogist 90 (2005) 240-246
The role of water in the structures of synthetic hallimondite, Pb2[(UO2)(AsO4)2](H2O)n
and synthetic parsonsite, Pb2[(UO2)(PO4)2](H2O)n, 0 < n < 0.5
_database_code_amcsd 0003721
6.8432 10.4105 6.6718 101.418 98.347 86.264 P-1
atom     x     y     z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
U1   .6163 .8401 .1140 .012   .016   .008   .011   .000   .003   .002
Pb1  .3010 .5450 .2703 .017   .018   .019   .014  -.001   .003   .003
Pb2  .0457 .7735 .7226 .017   .019   .011   .020   .000   .004   .000
P1   .5348 .8178 .6329 .011   .014   .008   .010   .001   .002   .001
P2   .8156 .5490 .2778 .011   .012   .009   .012   .001   .001   .002
O1   .9827 .6338 .4061 .016   .019   .013   .016  -.001   .002  -.001
O2   .3352 .4808 .5929 .018   .018   .020   .017  -.002   .003   .008
O3   .3673 .7895 .0765 .020   .019   .020   .022   .001   .002   .006
O4   .6695 .7313 .7665 .016   .024   .011   .013   .007   .004   .005
O5   .7018 .6219 .1158 .017   .026   .012   .013   .005   .001   .005
O6   .3402 .7547 .5399 .017   .015   .015   .021  -.003   .002   .002
O7   .5007 .0597 .1997 .017   .028   .009   .015   .005   .008   .004
O8   .8608 .8934 .1421 .022   .018   .026   .023  -.004   .001   .005
O9   .6434 .8524 .4693 .017   .025   .015   .012  -.004   .004   .004
O10  .9147 .4231 .1644 .017   .017   .014   .021   .004   .004   .007
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View JMOL 3-D Structure (permalink)
 
Li[(UO2)(PO4)](H2O)4
 
Locock A J, Burns P C, Duke M J M, Flynn T M
Download cm/vol42/CM42_973.pdf
The Canadian Mineralogist 42 (2004) 973-996
Monovalent cations in structures of the meta-autunite group
Sample: LiUP
_database_code_amcsd 0005943
6.9555 6.9555 9.1389 90 90 90 *P4/n
.25 -.25 0
atom    x      y      z Uiso
U     .25    .25  .0958 .013
P     .25    .75      0 .014
Li    .25    .75     .5 .030
O1    .25    .25  .2889 .024
O2    .25    .25 -.0989 .024
O3  .5780  .2931  .0997 .021
O4  .1894 -.0373  .6309 .032
H1   .157  -.083   .731  .05
H2   .108   .076   .613  .05
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View JMOL 3-D Structure (permalink)
 
Metanatroautunite
 
Locock A J, Burns P C, Duke M J M, Flynn T M
Download cm/vol42/CM42_973.pdf
The Canadian Mineralogist 42 (2004) 973-996
Monovalent cations in structures of the meta-autunite group
Sample: NaUP
_database_code_amcsd 0005944
6.9616 6.9616 17.2677 90 90 90 *P4/ncc
.25 -.25 0
atom    x     y     z occ Uiso
U     .25   .25 .0499     .017
P     .75   .25     0     .021
O1    .25   .25 .1534     .032
O2    .25   .25 .9480     .032
O3  .7162 .0759 .4469     .028
O4   .170 .9794 .3099 .75 .188
Na4  .170 .9794 .3099 .25 .188
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View JMOL 3-D Structure (permalink)
 
Na[(UO2)(AsO4)](H2O)3
 
Locock A J, Burns P C, Duke M J M, Flynn T M
Download cm/vol42/CM42_973.pdf
The Canadian Mineralogist 42 (2004) 973-996
Monovalent cations in structures of the meta-autunite group
Sample: NaUAs
_database_code_amcsd 0005945
7.1504 7.1504 17.325 90 90 90 *P4/ncc
.25 -.25 0
atom    x     y     z occ Uiso
U     .25   .25 .0542     .018
As    .75   .25     0     .020
O1    .25   .25 .1576     .031
O2    .25   .25 .9515     .036
O3  .7122 .0665 .4420     .029
O4  .1625 .9864 .3068 .75 .247
Na4 .1625 .9864 .3068 .25 .247
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View JMOL 3-D Structure (permalink)
 
K[(UO2)(AsO4)](H2O)3
 
Locock A J, Burns P C, Duke M J M, Flynn T M
Download cm/vol42/CM42_973.pdf
The Canadian Mineralogist 42 (2004) 973-996
Monovalent cations in structures of the meta-autunite group
Sample: KUAs
_database_code_amcsd 0005946
7.1669 7.1669 17.867 90 90 90 *P4/ncc
.25 -.25 0
atom    x     y     z  occ Uiso
U     .25   .25 .0529      .014
As    .75   .25     0      .016
O1    .25   .25 .1517      .027
O2    .25   .25 .9536      .030
O3  .7143 .0671 .4433      .020
O4  .1624 .9909 .3135 .773 .061
K4  .1624 .9909 .3135 .227 .061
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View JMOL 3-D Structure (permalink)
 
Rb[(UO2)(PO4)](H2O)3
 
Locock A J, Burns P C, Duke M J M, Flynn T M
Download cm/vol42/CM42_973.pdf
The Canadian Mineralogist 42 (2004) 973-996
Monovalent cations in structures of the meta-autunite group
Sample: RbUP
_database_code_amcsd 0005947
7.0106 7.0106 17.9772 90 90 90 *P4/ncc
.25 -.25 0
atom    x     y     z  occ Uiso
U     .25   .25 .0481      .016
P     .75   .25     0      .019
O1    .25   .25 .1468      .029
O2    .25   .25 .9487      .029
O3  .7270 .0756 .4492      .026
O4  .1738 .9769 .3157 .813 .055
Rb4 .1738 .9769 .3157 .187 .055
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View JMOL 3-D Structure (permalink)
 
Rb[(UO2)(AsO4)](H2O)3
 
Locock A J, Burns P C, Duke M J M, Flynn T M
Download cm/vol42/CM42_973.pdf
The Canadian Mineralogist 42 (2004) 973-996
Monovalent cations in structures of the meta-autunite group
Sample: RbUAs
_database_code_amcsd 0005948
7.1904 7.1904 17.643 90 90 90 *P4/n
.25 -.25 0
atom    x     y      z occ Uiso
U1    .25   .25  .0543     .012
U2    .25   .25  .5513     .012
As1   .25   .75      0     .013
As2   .25   .75     .5     .014
O1    .25   .25  .4504     .024
O2    .25   .25 -.0449     .028
O3    .25   .25  .6520     .022
O4    .25   .25  .1560     .020
O5  .2209 .9336  .0577     .020
O6  .2236 .9353  .5567     .024
O7  .5217 .3446  .3003  .5 .044
Rb7 .5217 .3446  .3003  .5 .044
O8  .1801 .5211 -.1910     .055
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View JMOL 3-D Structure (permalink)
 
Ag[(UO2)(PO4)](H2O)3
 
Locock A J, Burns P C, Duke M J M, Flynn T M
Download cm/vol42/CM42_973.pdf
The Canadian Mineralogist 42 (2004) 973-996
Monovalent cations in structures of the meta-autunite group
Sample: AgUP
_database_code_amcsd 0005949
6.9332 6.9332 16.9313 90 90 90 *P4/ncc
.25 -.25 0
atom    x     y     z  occ Uiso
U     .25   .25 .0518      .013
P     .75   .25     0      .016
O1    .25   .25 .1571      .025
O2    .25   .25 .9470      .026
O3  .7065 .0771 .4461      .023
O4  .1626 .9991 .3161 .782 .060
Ag4 .1626 .9991 .3161 .218 .060
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View JMOL 3-D Structure (permalink)
 
Ag[(UO2)(AsO4)](H2O)3
 
Locock A J, Burns P C, Duke M J M, Flynn T M
Download cm/vol42/CM42_973.pdf
The Canadian Mineralogist 42 (2004) 973-996
Monovalent cations in structures of the meta-autunite group
Sample: AgUAs
_database_code_amcsd 0005950
7.0901 7.0901 17.0453 90 90 90 *P4/ncc
.25 -.25 0
atom    x     y     z  occ Uiso
U     .25   .25 .0560      .014
As    .75   .25     0      .016
O1    .25   .25 .1595      .025
O2    .25   .25 .9525      .027
O3  .6990 .0680 .4409      .023
O4  .1557 .0111 .3159 .767 .064
Ag4 .1557 .0111 .3159 .233 .064
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View JMOL 3-D Structure (permalink)
 
Tl[(UO2)(PO4)](H2O)3
 
Locock A J, Burns P C, Duke M J M, Flynn T M
Download cm/vol42/CM42_973.pdf
The Canadian Mineralogist 42 (2004) 973-996
Monovalent cations in structures of the meta-autunite group
Sample: TlUP
_database_code_amcsd 0005951
7.019 7.019 17.98 90 90 90 *P4/ncc
.25 -.25 0
atom    x     y     z  occ Uiso
U     .25   .25 .0483      .014
P     .75   .25     0      .015
O1    .25   .25 .1490      .024
O2    .25   .25 .9483      .024
O3  .7279 .0740 .4491      .022
O4  .1699 .9858 .3158 .755 .054
Tl4 .1699 .9858 .3158 .245 .054
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View JMOL 3-D Structure (permalink)
 
Tl[(UO2)(AsO4)](H2O)3
 
Locock A J, Burns P C, Duke M J M, Flynn T M
Download cm/vol42/CM42_973.pdf
The Canadian Mineralogist 42 (2004) 973-996
Monovalent cations in structures of the meta-autunite group
Sample: TlUAs
_database_code_amcsd 0005952
7.1905 7.1905 17.970 90 90 90 *P4/ncc
.25 -.25 0
atom    x      y     z  occ Uiso
U     .25    .25 .0529      .016
As    .75    .25     0      .018
O1    .25    .25 .1512      .026
O2    .25    .25 .9548      .029
O3  .7191  .0659 .4437      .025
O4  .1707 -.0057 .3133 .252 .063
Tl4 .1707 -.0057 .3133 .748 .063
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View JMOL 3-D Structure (permalink)
 
Cs2[(UO2)(PO4)]2(H2O)5
 
Locock A J, Burns P C, Duke M J M, Flynn T M
Download cm/vol42/CM42_973.pdf
The Canadian Mineralogist 42 (2004) 973-996
Monovalent cations in structures of the meta-autunite group
Sample: CsUP
_database_code_amcsd 0005953
9.8716 9.9550 17.6465 90 90.402 90 P2_1/n
atom      x     y      z Uiso
U1    .7443 .0002  .0470 .012
U2    .2551 .0035  .4497 .012
P1    .5002 .7457 -.0020 .014
P2    .0001 .7521 -.0028 .014
Cs1   .0894 .9071  .1944 .035
Cs2   .8064 .3094  .2019 .041
O1    .5832 .8391  .0492 .024
O2    .4206 .1632  .4470 .019
O3    .0887 .1615  .4501 .022
O4    .0911 .8429  .4505 .027
O5    .9113 .8448  .0448 .021
O6    .5873 .1696  .0567 .020
O7    .4130 .8341  .4438 .020
O8    .7381 .0064 -.0526 .022
O9    .2632 .0036  .5503 .023
O10   .2510 .0062  .3484 .020
O11   .7520 .9959  .1485 .021
O12   .0960 .8350 -.0521 .021
Wat13 .1653 .2024  .1907 .038
Wat14 .4320 .1394  .1917 .047
Wat15 .0759 .3580  .3070 .050
Wat16 .9122 .0668  .3152 .040
Wat17 .6127 .1265  .3120 .045
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View JMOL 3-D Structure (permalink)
 
Cs(H3O)[(UO2)(AsO4)]2(H2O)5
 
Locock A J, Burns P C, Duke M J M, Flynn T M
Download cm/vol42/CM42_973.pdf
The Canadian Mineralogist 42 (2004) 973-996
Monovalent cations in structures of the meta-autunite group
Sample: CsUAs
_database_code_amcsd 0005954
14.2614 7.1428 17.221 90 91.110 90 P2_1/n
atom        x      y      z Uiso
U1      .1252  .2461  .0531 .012
U2      .6245  .2443  .0540 .011
As1     .3750  .2527  .0007 .013
As2    -.1262  .2515 -.0015 .013
Cs1     .4521 -.6027  .2516 .046
O1      .6211  .2390 -.0479 .024
O2      .1229  .2450 -.0491 .021
O3      .6271  .2456  .1579 .017
O4      .1259  .2459  .1562 .019
O5      .3959  .0752 -.0605 .018
O6     -.1046  .0689 -.0594 .020
O7     -.0338  .2978  .0598 .016
O8      .4670  .2903  .0605 .019
O9     -.2164  .2088  .0570 .018
O10     .2833  .2023  .0570 .019
O11     .3505  .4396 -.0555 .018
O12    -.1496  .4366 -.0584 .021
Wat13   .6636  .0071 -.1894 .040
Wat14   .1644  -.116 -.1934 .031
Wat15   .7386  .3735 -.1913 .054
Wat16   .0754  .5092 -.1881 .034
Wat17   .4892  .1658 -.1945 .030
OH318   .2377  .3622 -.1865 .027
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View JMOL 3-D Structure (permalink)
 
Sr[(UO2)(PO4)]2(H2O)11
 
Locock A J, Burns P C, Flynn T M
Download cm/vol43/CM43_721.pdf
The Canadian Mineralogist 43 (2005) 721-733
Structures of strontium- and barium-dominant compounds that contain the autunite-type sheet
Sample: SrUP11
_database_code_amcsd 0006006
14.042 21.008 6.997 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)
U     .1249  .5414  .7483      .012   .010   .017   .009   .001      0      0
P     .1238  .5003  .2461      .014   .010   .021   .010   .003  -.001  -.001
Sr    .1247    .75  .4687 .795 .020   .013   .026   .020      0      0      0
O1    .1239  .4567  .7473      .027   .027   .022   .031   .014      0      0
O2    .1220  .6260  .7428      .022   .017   .021   .026   .002  -.001      0
O3    .1251  .5437  .0698      .028   .038   .036   .009  -.004  -.003   .005
O4    .0363  .4583  .2434      .027   .008   .032   .040  -.004      0   .001
O5    .2109  .4556  .2533      .022   .014   .026   .026  -.003   .002  -.001
O6    .1205  .5453  .4214      .022   .025   .034   .008  -.004   .001  -.002
Wat7  .7446    .25  .2671      .039   .052   .022   .044      0  -.009      0
Wat8  .2405  .6593  .3450      .065   .036   .022   .136   .006   .022  -.005
Wat9  .0087  .6593  .3535      .059   .047   .040   .090  -.010  -.023   .002
Wat10 .9982    .25  .2630      .039   .042   .029   .044      0   .020      0
Wat11 .1245    .75  .0660      .040   .024   .051   .045      0  -.003      0
Wat12 .1772  .3431  .4787      .051   .051   .040   .060  -.002   .014  -.011
Wat13 .0720  .3433  .0189      .052   .056   .039   .061   .005   .024      0
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View JMOL 3-D Structure (permalink)
 
Sr[(UO2)(AsO4)]2(H2O)8
 
Locock A J, Burns P C, Flynn T M
Download cm/vol43/CM43_721.pdf
The Canadian Mineralogist 43 (2005) 721-733
Structures of strontium- and barium-dominant compounds that contain the autunite-type sheet
Sample: SrUAs8
_database_code_amcsd 0006007
7.154 7.101 18.901 90 92.67 90 P2/c
atom         x       y      z  Uiso
U1       .2536   .2592  .0499  .016
As1      .7439   .2492  .0007  .017
Sr1          0   .1687    .25  .026
O1        .254    .267  -.045  .014
O2        .245    .250   .145  .015
O3        .938    .296   .050  .021
O4        .569    .218   .057  .023
O5        .776    .057  -.049  .029
O6        .695    .424  -.057  .011
Wat7      .112    .475   .320  .032
Wat8      .037    .879   .174  .046
Wat9      .661    .079   .198  .038
Wat10     .560    .682   .183  .039
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View JMOL 3-D Structure (permalink)
 
Sr[(UO2)(AsO4)]2(H2O)11
 
Locock A J, Burns P C, Flynn T M
Download cm/vol43/CM43_721.pdf
The Canadian Mineralogist 43 (2005) 721-733
Structures of strontium- and barium-dominant compounds that contain the autunite-type sheet
Sample: SrUAs11
_database_code_amcsd 0006008
14.3778 20.9611 7.1703 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)
U     .1251  .5451  .7485      .014   .010   .019   .012      0      0      0
As    .1251  .5002  .2451      .016   .010   .025   .014      0      0  -.001
Sr    .1249    .75  .4820 .840 .034   .023   .044   .033      0      0      0
O1    .1256  .4605  .7488      .029
O2    .1263  .6304  .7420      .024
O3    .1284  .5488  .0634      .031
O4    .0326  .4503  .2426      .024
O5    .2170  .4532  .2515      .036
O6    .1224  .5487  .4298      .029
Wat7  .7619    .25  .2628      .109
Wat8  .2418  .6621  .3670      .075
Wat9  .0081  .6627  .3683      .072
Wat10 .0049    .25  .2577      .037
Wat11 .1247    .75  .0588      .047
Wat12 .3209  .6587 -.0114      .073
Wat13 .0710  .3409  .0103      .072
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View JMOL 3-D Structure (permalink)
 
Heinrichite
Download hom/heinrichite.pdf
Locock A J, Burns P C, Flynn T M
Download cm/vol43/CM43_721.pdf
The Canadian Mineralogist 43 (2005) 721-733
Structures of strontium- and barium-dominant compounds that contain the autunite-type sheet
_database_code_amcsd 0006009
7.1548 7.1340 21.290 90 104.171 90 P2/c
atom      x      y      z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
U     .2861  .7488  .0440 .013   .012   .011   .015      0   .003      0
As    .2462  .2486  .0011 .014   .012   .011   .019      0   .004      0
Ba       .5 -.0417    .25 .024   .025   .025   .020      0   .003      0
O1    .3520  .7528  .1308 .019   .022   .015   .021   .002   .004      0
O2    .3200  .4323  .0502 .022   .032   .011   .020  -.004   .003  -.004
O3    .2436  .0635  .0497 .021   .027   .011   .027      0   .011   .004
O4    .3966  .2112 -.0469 .019   .012   .024   .024  -.003   .009  -.002
O5    .0284  .2857 -.0477 .021   .014   .026   .025  -.001   .005   .002
O6    .2234  .7473 -.0418 .024   .027   .028   .018   .001   .007   .001
Wat7  .1406  .1012  .1747 .043   .033   .049   .047   .007   .009  -.005
Wat8  .7529 -.0049  .1623 .043   .051   .048   .032  -.015   .015  -.002
Wat9  .5252  .3046  .1772 .048   .063   .035   .038  -.003      0   .001
Wat10 .2806  .6324  .2615 .043   .041   .048   .039  -.009   .008  -.004
Wat11 .0189  .5071  .3373 .051   .064   .061   .031   .015   .015   .009
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Meta-uranocircite I
Download hom/metauranocircitei.pdf
Locock A J, Burns P C, Flynn T M
Download cm/vol43/CM43_721.pdf
The Canadian Mineralogist 43 (2005) 721-733
Structures of strontium- and barium-dominant compounds that contain the autunite-type sheet
_database_code_amcsd 0006010
6.943 17.634 6.952 90 90.023 90 P2_1
atom       x      y      z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
U1     .5350  .0711  .5464 .012   .009   .017   .009      0  -.001      0
U2     .0412  .1665  .0404 .011   .006   .018   .010      0  -.002      0
Ba     .3984  .3399  .1804 .027   .023   .033   .024  -.007  -.001  -.005
P1     .0362  .1180 -.4591 .013   .007   .022   .009      0  -.001   .001
P2     .5348  .1203  .0518 .013   .007   .020   .012  -.001      0      0
O1     .5360  .1725  .5350 .026
O2     .0440  .0670  .0420 .020
O3     .4893  .0768  .8716 .019
O4     .5690  .0670  .2186 .013
O5     .2107  .0676 -.4911 .016
O6    -.2830  .1714  .0200 .021
O7    -.1406  .0700 -.4252 .019
O8     .0660  .1732 -.2850 .023
O9     .0062  .1716 -.6330 .020
O10    .3674  .1773  .0969 .013
O11    .5380 -.0295  .5616 .016
O12    .0480  .2694  .0400 .017
Wat13  .2560  .3072  .5540 .040
Wat14  .6930  .4329  .0570 .037
Wat15  .7520  .3109  .3880 .033
Wat16  .2420  .4226 -.1380 .042
Wat17 -.0520 -.0803 -.2660 .030
Wat18  .5800  .3029 -.1760 .044
Wat19  .1390 -.0770 -.7100 .049
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Metauranocircite I
Download hom/metauranocircitei.pdf
Locock A J, Burns P C, Flynn T M
Download cm/vol43/CM43_721.pdf
The Canadian Mineralogist 43 (2005) 721-733
Structures of strontium- and barium-dominant compounds that contain the autunite-type sheet
_database_code_amcsd 0006011
6.943 17.634 6.952 90 90.023 90 P2_1
atom       x      y      z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
U1     .5350  .0711  .5464 .012   .009   .017   .009      0  -.001      0
U2     .0412  .1665  .0404 .011   .006   .018   .010      0  -.002      0
Ba     .3984  .3399  .1804 .027   .023   .033   .024  -.007  -.001  -.005
P1     .0362  .1180 -.4591 .013   .007   .022   .009      0  -.001   .001
P2     .5348  .1203  .0518 .013   .007   .020   .012  -.001      0      0
O1     .5360  .1725  .5350 .026
O2     .0440  .0670  .0420 .020
O3     .4893  .0768  .8716 .019
O4     .5690  .0670  .2186 .013
O5     .2107  .0676 -.4911 .016
O6    -.2830  .1714  .0200 .021
O7    -.1406  .0700 -.4252 .019
O8     .0660  .1732 -.2850 .023
O9     .0062  .1716 -.6330 .020
O10    .3674  .1773  .0969 .013
O11    .5380 -.0295  .5616 .016
O12    .0480  .2694  .0400 .017
Wat13  .2560  .3072  .5540 .040
Wat14  .6930  .4329  .0570 .037
Wat15  .7520  .3109  .3880 .033
Wat16  .2420  .4226 -.1380 .042
Wat17 -.0520 -.0803 -.2660 .030
Wat18  .5800  .3029 -.1760 .044
Wat19  .1390 -.0770 -.7100 .049
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Metauranocircite II
 
Locock A J, Burns P C, Flynn T M
Download cm/vol43/CM43_721.pdf
The Canadian Mineralogist 43 (2005) 721-733
Structures of strontium- and barium-dominant compounds that contain the autunite-type sheet
_database_code_amcsd 0006012
9.882 16.868 9.789 90 90.52 90 P2_1/c
atom       x       y      z  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
U1   -.50710 -.79811 .73137 .0146  .0144  .0146  .0148  .0000 -.0022 -.0018
U2   -.00705 -.69617 .72978 .0147  .0154  .0152  .0133  .0005 -.0004  .0015
Ba   -.82940 -.94228 .87402 .0348  .0344  .0247  .0451 -.0028  .0011  .0013
P1    -.7622  -.7576  .4757  .018
P2    -.2579  -.7585  .4799  .018
O1    -.5174  -.9050  .7406  .025
O2    -.5096  -.6951  .7141  .023
O3    -.0114  -.5934  .7071  .035
O4    -.9919  -.8019  .7502  .022
O5    -.8583  -.8168  .4041  .023
O6    -.8420  -.7029  .5640  .038
O7    -.6630  -.8026  .5574  .022
O8    -.7014  -.7066  .3665  .038
O9    -.1591  -.7016  .5496  .042
O10   -.3621  -.7074  .4025  .029
O11   -.1823  -.8115  .3763  .033
Wat13 -.3348  -.8109  .5834  .010
Wat14 -.1185  -.9415  .9197  .038
Wat15 -.8972  -.9462  .5905  .046
Wat16 -.6089  -.9526  .0658  .073
Wat17 -.6752  -.0513  .7361  .055
Wat18 -.5784  -.9546  .4132  .047
Wat19 -.2100  -.9637  .6508  .057
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Meta-uranocircite II
 
Locock A J, Burns P C, Flynn T M
Download cm/vol43/CM43_721.pdf
The Canadian Mineralogist 43 (2005) 721-733
Structures of strontium- and barium-dominant compounds that contain the autunite-type sheet
_database_code_amcsd 0006013
9.882 16.868 9.789 90 90.52 90 P2_1/c
atom       x       y      z  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
U1   -.50710 -.79811 .73137 .0146  .0144  .0146  .0148  .0000 -.0022 -.0018
U2   -.00705 -.69617 .72978 .0147  .0154  .0152  .0133  .0005 -.0004  .0015
Ba   -.82940 -.94228 .87402 .0348  .0344  .0247  .0451 -.0028  .0011  .0013
P1    -.7622  -.7576  .4757  .018
P2    -.2579  -.7585  .4799  .018
O1    -.5174  -.9050  .7406  .025
O2    -.5096  -.6951  .7141  .023
O3    -.0114  -.5934  .7071  .035
O4    -.9919  -.8019  .7502  .022
O5    -.8583  -.8168  .4041  .023
O6    -.8420  -.7029  .5640  .038
O7    -.6630  -.8026  .5574  .022
O8    -.7014  -.7066  .3665  .038
O9    -.1591  -.7016  .5496  .042
O10   -.3621  -.7074  .4025  .029
O11   -.1823  -.8115  .3763  .033
Wat13 -.3348  -.8109  .5834  .010
Wat14 -.1185  -.9415  .9197  .038
Wat15 -.8972  -.9462  .5905  .046
Wat16 -.6089  -.9526  .0658  .073
Wat17 -.6752  -.0513  .7361  .055
Wat18 -.5784  -.9546  .4132  .047
Wat19 -.2100  -.9637  .6508  .057
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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Total number of retrieved datasets: 22
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