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Hallimondite |
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Locock A J, Burns P C, Flynn T M |
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American Mineralogist 90 (2005) 240-246 |
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The role of water in the structures of synthetic hallimondite, Pb2[(UO2)(AsO4)2](H2O)n |
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and synthetic parsonsite, Pb2[(UO2)(PO4)2](H2O)n, 0 < n < 0.5 |
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7.1153 10.4780 6.8571 101.178 95.711 86.651 P-1 |
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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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U1 .6186 .8400 .0988 .010 .016 .007 .008 .001 .003 .001 |
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Pb1 .3090 .5416 .2785 .016 .018 .019 .012 -.001 .003 .002 |
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Pb2 .0451 .7776 .7170 .018 .021 .012 .022 .001 .006 .000 |
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As1 .5365 .8167 .6206 .009 .013 .007 .007 .000 .002 .000 |
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As2 .8238 .5494 .2763 .010 .011 .009 .009 .001 .001 .002 |
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O1 .0022 .6340 .4155 .018 .012 .022 .018 -.005 -.002 .000 |
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O2 .3486 .4738 .5851 .014 .013 .019 .013 .000 .005 .007 |
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O3 .3859 .7840 .0731 .021 .019 .025 .019 -.004 .002 .005 |
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O4 .6811 .7288 .7623 .015 .022 .015 .007 .003 .000 .002 |
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O5 .7149 .6298 .1057 .020 .034 .011 .013 .006 -.001 .004 |
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O6 .3323 .7477 .5346 .017 .014 .017 .017 -.004 .002 -.003 |
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O7 .5018 .0540 .1927 .019 .040 .009 .008 .008 .002 .001 |
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O8 .8504 .8978 .1144 .021 .022 .022 .021 -.009 .005 .002 |
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O9 .6524 .8562 .4429 .019 .022 .023 .013 -.002 .004 .005 |
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O10 .9230 .4099 .1582 .021 .029 .014 .019 .009 .009 .002 |
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Wat11 .0500 .9720 .4740 .29 .073 |
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Parsonsite |
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Locock A J, Burns P C, Flynn T M |
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American Mineralogist 90 (2005) 240-246 |
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The role of water in the structures of synthetic hallimondite, Pb2[(UO2)(AsO4)2](H2O)n |
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and synthetic parsonsite, Pb2[(UO2)(PO4)2](H2O)n, 0 < n < 0.5 |
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6.8432 10.4105 6.6718 101.418 98.347 86.264 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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U1 .6163 .8401 .1140 .012 .016 .008 .011 .000 .003 .002 |
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Pb1 .3010 .5450 .2703 .017 .018 .019 .014 -.001 .003 .003 |
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Pb2 .0457 .7735 .7226 .017 .019 .011 .020 .000 .004 .000 |
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P1 .5348 .8178 .6329 .011 .014 .008 .010 .001 .002 .001 |
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P2 .8156 .5490 .2778 .011 .012 .009 .012 .001 .001 .002 |
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O1 .9827 .6338 .4061 .016 .019 .013 .016 -.001 .002 -.001 |
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O2 .3352 .4808 .5929 .018 .018 .020 .017 -.002 .003 .008 |
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O3 .3673 .7895 .0765 .020 .019 .020 .022 .001 .002 .006 |
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O4 .6695 .7313 .7665 .016 .024 .011 .013 .007 .004 .005 |
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O5 .7018 .6219 .1158 .017 .026 .012 .013 .005 .001 .005 |
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O6 .3402 .7547 .5399 .017 .015 .015 .021 -.003 .002 .002 |
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O7 .5007 .0597 .1997 .017 .028 .009 .015 .005 .008 .004 |
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O8 .8608 .8934 .1421 .022 .018 .026 .023 -.004 .001 .005 |
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O9 .6434 .8524 .4693 .017 .025 .015 .012 -.004 .004 .004 |
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O10 .9147 .4231 .1644 .017 .017 .014 .021 .004 .004 .007 |
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Li[(UO2)(PO4)](H2O)4 |
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Locock A J, Burns P C, Duke M J M, Flynn T M |
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The Canadian Mineralogist 42 (2004) 973-996 |
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Monovalent cations in structures of the meta-autunite group |
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Sample: LiUP |
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6.9555 6.9555 9.1389 90 90 90 *P4/n |
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.25 -.25 0 |
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atom x y z Uiso |
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U .25 .25 .0958 .013 |
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P .25 .75 0 .014 |
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Li .25 .75 .5 .030 |
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O1 .25 .25 .2889 .024 |
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O2 .25 .25 -.0989 .024 |
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O3 .5780 .2931 .0997 .021 |
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O4 .1894 -.0373 .6309 .032 |
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H1 .157 -.083 .731 .05 |
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H2 .108 .076 .613 .05 |
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Na[(UO2)(PO4)](H2O)3 |
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Locock A J, Burns P C, Duke M J M, Flynn T M |
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The Canadian Mineralogist 42 (2004) 973-996 |
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Monovalent cations in structures of the meta-autunite group |
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Sample: NaUP |
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6.9616 6.9616 17.2677 90 90 90 *P4/ncc |
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.25 -.25 0 |
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atom x y z occ Uiso |
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U .25 .25 .0499 .017 |
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P .75 .25 0 .021 |
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O1 .25 .25 .1534 .032 |
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O2 .25 .25 .9480 .032 |
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O3 .7162 .0759 .4469 .028 |
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O4 .170 .9794 .3099 .75 .188 |
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Na4 .170 .9794 .3099 .25 .188 |
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Na[(UO2)(AsO4)](H2O)3 |
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Locock A J, Burns P C, Duke M J M, Flynn T M |
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The Canadian Mineralogist 42 (2004) 973-996 |
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Monovalent cations in structures of the meta-autunite group |
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Sample: NaUAs |
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7.1504 7.1504 17.325 90 90 90 *P4/ncc |
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.25 -.25 0 |
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atom x y z occ Uiso |
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U .25 .25 .0542 .018 |
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As .75 .25 0 .020 |
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O1 .25 .25 .1576 .031 |
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O2 .25 .25 .9515 .036 |
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O3 .7122 .0665 .4420 .029 |
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O4 .1625 .9864 .3068 .75 .247 |
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Na4 .1625 .9864 .3068 .25 .247 |
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K[(UO2)(AsO4)](H2O)3 |
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Locock A J, Burns P C, Duke M J M, Flynn T M |
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The Canadian Mineralogist 42 (2004) 973-996 |
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Monovalent cations in structures of the meta-autunite group |
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Sample: KUAs |
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7.1669 7.1669 17.867 90 90 90 *P4/ncc |
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.25 -.25 0 |
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atom x y z occ Uiso |
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U .25 .25 .0529 .014 |
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As .75 .25 0 .016 |
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O1 .25 .25 .1517 .027 |
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O2 .25 .25 .9536 .030 |
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O3 .7143 .0671 .4433 .020 |
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O4 .1624 .9909 .3135 .773 .061 |
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K4 .1624 .9909 .3135 .227 .061 |
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| Download AMC data (View Text File)
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View JMOL 3-D Structure
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Rb[(UO2)(PO4)](H2O)3 |
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Locock A J, Burns P C, Duke M J M, Flynn T M |
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The Canadian Mineralogist 42 (2004) 973-996 |
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Monovalent cations in structures of the meta-autunite group |
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Sample: RbUP |
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7.0106 7.0106 17.9772 90 90 90 *P4/ncc |
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.25 -.25 0 |
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atom x y z occ Uiso |
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U .25 .25 .0481 .016 |
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P .75 .25 0 .019 |
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O1 .25 .25 .1468 .029 |
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O2 .25 .25 .9487 .029 |
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O3 .7270 .0756 .4492 .026 |
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O4 .1738 .9769 .3157 .813 .055 |
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Rb4 .1738 .9769 .3157 .187 .055 |
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| Download AMC data (View Text File)
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View JMOL 3-D Structure
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Rb[(UO2)(AsO4)](H2O)3 |
| |
Locock A J, Burns P C, Duke M J M, Flynn T M |
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The Canadian Mineralogist 42 (2004) 973-996 |
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Monovalent cations in structures of the meta-autunite group |
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Sample: RbUAs |
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7.1904 7.1904 17.643 90 90 90 *P4/n |
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.25 -.25 0 |
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atom x y z occ Uiso |
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U1 .25 .25 .0543 .012 |
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U2 .25 .25 .5513 .012 |
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As1 .25 .75 0 .013 |
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As2 .25 .75 .5 .014 |
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O1 .25 .25 .4504 .024 |
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O2 .25 .25 -.0449 .028 |
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O3 .25 .25 .6520 .022 |
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O4 .25 .25 .1560 .020 |
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O5 .2209 .9336 .0577 .020 |
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O6 .2236 .9353 .5567 .024 |
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O7 .5217 .3446 .3003 .5 .044 |
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Rb7 .5217 .3446 .3003 .5 .044 |
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O8 .1801 .5211 -.1910 .055 |
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| Download AMC data (View Text File)
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View JMOL 3-D Structure
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Ag[(UO2)(PO4)](H2O)3 |
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Locock A J, Burns P C, Duke M J M, Flynn T M |
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The Canadian Mineralogist 42 (2004) 973-996 |
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Monovalent cations in structures of the meta-autunite group |
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Sample: AgUP |
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6.9332 6.9332 16.9313 90 90 90 *P4/ncc |
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.25 -.25 0 |
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atom x y z occ Uiso |
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U .25 .25 .0518 .013 |
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P .75 .25 0 .016 |
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O1 .25 .25 .1571 .025 |
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O2 .25 .25 .9470 .026 |
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O3 .7065 .0771 .4461 .023 |
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O4 .1626 .9991 .3161 .782 .060 |
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Ag4 .1626 .9991 .3161 .218 .060 |
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| Download AMC data (View Text File)
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View JMOL 3-D Structure
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Ag[(UO2)(AsO4)](H2O)3 |
| |
Locock A J, Burns P C, Duke M J M, Flynn T M |
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The Canadian Mineralogist 42 (2004) 973-996 |
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Monovalent cations in structures of the meta-autunite group |
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Sample: AgUAs |
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7.0901 7.0901 17.0453 90 90 90 *P4/ncc |
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.25 -.25 0 |
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atom x y z occ Uiso |
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U .25 .25 .0560 .014 |
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As .75 .25 0 .016 |
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O1 .25 .25 .1595 .025 |
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O2 .25 .25 .9525 .027 |
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O3 .6990 .0680 .4409 .023 |
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O4 .1557 .0111 .3159 .767 .064 |
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Ag4 .1557 .0111 .3159 .233 .064 |
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| Download AMC data (View Text File)
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View JMOL 3-D Structure
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Tl[(UO2)(PO4)](H2O)3 |
| |
Locock A J, Burns P C, Duke M J M, Flynn T M |
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The Canadian Mineralogist 42 (2004) 973-996 |
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Monovalent cations in structures of the meta-autunite group |
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Sample: TlUP |
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7.019 7.019 17.98 90 90 90 *P4/ncc |
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.25 -.25 0 |
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atom x y z occ Uiso |
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U .25 .25 .0483 .014 |
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P .75 .25 0 .015 |
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O1 .25 .25 .1490 .024 |
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O2 .25 .25 .9483 .024 |
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O3 .7279 .0740 .4491 .022 |
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O4 .1699 .9858 .3158 .755 .054 |
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Tl4 .1699 .9858 .3158 .245 .054 |
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|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
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Tl[(UO2)(AsO4)](H2O)3 |
| |
Locock A J, Burns P C, Duke M J M, Flynn T M |
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The Canadian Mineralogist 42 (2004) 973-996 |
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Monovalent cations in structures of the meta-autunite group |
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Sample: TlUAs |
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7.1905 7.1905 17.970 90 90 90 *P4/ncc |
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.25 -.25 0 |
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atom x y z occ Uiso |
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U .25 .25 .0529 .016 |
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As .75 .25 0 .018 |
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O1 .25 .25 .1512 .026 |
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O2 .25 .25 .9548 .029 |
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O3 .7191 .0659 .4437 .025 |
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O4 .1707 -.0057 .3133 .252 .063 |
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Tl4 .1707 -.0057 .3133 .748 .063 |
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|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
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Cs2[(UO2)(PO4)]2(H2O)5 |
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Locock A J, Burns P C, Duke M J M, Flynn T M |
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The Canadian Mineralogist 42 (2004) 973-996 |
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Monovalent cations in structures of the meta-autunite group |
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Sample: CsUP |
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9.8716 9.9550 17.6465 90 90.402 90 P2_1/n |
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atom x y z Uiso |
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U1 .7443 .0002 .0470 .012 |
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U2 .2551 .0035 .4497 .012 |
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P1 .5002 .7457 -.0020 .014 |
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P2 .0001 .7521 -.0028 .014 |
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Cs1 .0894 .9071 .1944 .035 |
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Cs2 .8064 .3094 .2019 .041 |
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O1 .5832 .8391 .0492 .024 |
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O2 .4206 .1632 .4470 .019 |
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O3 .0887 .1615 .4501 .022 |
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O4 .0911 .8429 .4505 .027 |
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O5 .9113 .8448 .0448 .021 |
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O6 .5873 .1696 .0567 .020 |
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O7 .4130 .8341 .4438 .020 |
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O8 .7381 .0064 -.0526 .022 |
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O9 .2632 .0036 .5503 .023 |
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O10 .2510 .0062 .3484 .020 |
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O11 .7520 .9959 .1485 .021 |
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O12 .0960 .8350 -.0521 .021 |
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Wat13 .1653 .2024 .1907 .038 |
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Wat14 .4320 .1394 .1917 .047 |
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Wat15 .0759 .3580 .3070 .050 |
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Wat16 .9122 .0668 .3152 .040 |
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Wat17 .6127 .1265 .3120 .045 |
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| Download AMC data (View Text File)
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View JMOL 3-D Structure
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Cs(H3O)[(UO2)(AsO4)]2(H2O)5 |
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Locock A J, Burns P C, Duke M J M, Flynn T M |
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The Canadian Mineralogist 42 (2004) 973-996 |
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Monovalent cations in structures of the meta-autunite group |
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Sample: CsUAs |
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14.2614 7.1428 17.221 90 91.110 90 P2_1/n |
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atom x y z Uiso |
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U1 .1252 .2461 .0531 .012 |
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U2 .6245 .2443 .0540 .011 |
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As1 .3750 .2527 .0007 .013 |
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As2 -.1262 .2515 -.0015 .013 |
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Cs1 .4521 -.6027 .2516 .046 |
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O1 .6211 .2390 -.0479 .024 |
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O2 .1229 .2450 -.0491 .021 |
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O3 .6271 .2456 .1579 .017 |
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O4 .1259 .2459 .1562 .019 |
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O5 .3959 .0752 -.0605 .018 |
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O6 -.1046 .0689 -.0594 .020 |
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O7 -.0338 .2978 .0598 .016 |
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O8 .4670 .2903 .0605 .019 |
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O9 -.2164 .2088 .0570 .018 |
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O10 .2833 .2023 .0570 .019 |
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O11 .3505 .4396 -.0555 .018 |
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O12 -.1496 .4366 -.0584 .021 |
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Wat13 .6636 .0071 -.1894 .040 |
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Wat14 .1644 -.116 -.1934 .031 |
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Wat15 .7386 .3735 -.1913 .054 |
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Wat16 .0754 .5092 -.1881 .034 |
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Wat17 .4892 .1658 -.1945 .030 |
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OH318 .2377 .3622 -.1865 .027 |
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|
| Download AMC data (View Text File)
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Sr[(UO2)(PO4)]2(H2O)11 |
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Locock A J, Burns P C, Flynn T M |
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The Canadian Mineralogist 43 (2005) 721-733 |
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Structures of strontium- and barium-dominant compounds that contain the autunite-type sheet |
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Sample: SrUP11 |
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14.042 21.008 6.997 90 90 90 Pnma |
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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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U .1249 .5414 .7483 .012 .010 .017 .009 .001 0 0 |
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P .1238 .5003 .2461 .014 .010 .021 .010 .003 -.001 -.001 |
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Sr .1247 .75 .4687 .795 .020 .013 .026 .020 0 0 0 |
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O1 .1239 .4567 .7473 .027 .027 .022 .031 .014 0 0 |
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O2 .1220 .6260 .7428 .022 .017 .021 .026 .002 -.001 0 |
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O3 .1251 .5437 .0698 .028 .038 .036 .009 -.004 -.003 .005 |
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O4 .0363 .4583 .2434 .027 .008 .032 .040 -.004 0 .001 |
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O5 .2109 .4556 .2533 .022 .014 .026 .026 -.003 .002 -.001 |
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O6 .1205 .5453 .4214 .022 .025 .034 .008 -.004 .001 -.002 |
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Wat7 .7446 .25 .2671 .039 .052 .022 .044 0 -.009 0 |
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Wat8 .2405 .6593 .3450 .065 .036 .022 .136 .006 .022 -.005 |
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Wat9 .0087 .6593 .3535 .059 .047 .040 .090 -.010 -.023 .002 |
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Wat10 .9982 .25 .2630 .039 .042 .029 .044 0 .020 0 |
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Wat11 .1245 .75 .0660 .040 .024 .051 .045 0 -.003 0 |
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Wat12 .1772 .3431 .4787 .051 .051 .040 .060 -.002 .014 -.011 |
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Wat13 .0720 .3433 .0189 .052 .056 .039 .061 .005 .024 0 |
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|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
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Sr[(UO2)(AsO4)]2(H2O)8 |
| |
Locock A J, Burns P C, Flynn T M |
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The Canadian Mineralogist 43 (2005) 721-733 |
|
Structures of strontium- and barium-dominant compounds that contain the autunite-type sheet |
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Sample: SrUAs8 |
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7.154 7.101 18.901 90 92.67 90 P2/c |
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atom x y z Uiso |
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U1 .2536 .2592 .0499 .016 |
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As1 .7439 .2492 .0007 .017 |
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Sr1 0 .1687 .25 .026 |
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O1 .254 .267 -.045 .014 |
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O2 .245 .250 .145 .015 |
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O3 .938 .296 .050 .021 |
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O4 .569 .218 .057 .023 |
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O5 .776 .057 -.049 .029 |
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O6 .695 .424 -.057 .011 |
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Wat7 .112 .475 .320 .032 |
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Wat8 .037 .879 .174 .046 |
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Wat9 .661 .079 .198 .038 |
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Wat10 .560 .682 .183 .039 |
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|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Sr[(UO2)(AsO4)]2(H2O)11 |
| |
Locock A J, Burns P C, Flynn T M |
|
The Canadian Mineralogist 43 (2005) 721-733 |
|
Structures of strontium- and barium-dominant compounds that contain the autunite-type sheet |
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Sample: SrUAs11 |
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14.3778 20.9611 7.1703 90 90 90 Pnma |
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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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U .1251 .5451 .7485 .014 .010 .019 .012 0 0 0 |
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As .1251 .5002 .2451 .016 .010 .025 .014 0 0 -.001 |
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Sr .1249 .75 .4820 .840 .034 .023 .044 .033 0 0 0 |
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O1 .1256 .4605 .7488 .029 |
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O2 .1263 .6304 .7420 .024 |
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O3 .1284 .5488 .0634 .031 |
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O4 .0326 .4503 .2426 .024 |
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O5 .2170 .4532 .2515 .036 |
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O6 .1224 .5487 .4298 .029 |
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Wat7 .7619 .25 .2628 .109 |
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Wat8 .2418 .6621 .3670 .075 |
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Wat9 .0081 .6627 .3683 .072 |
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Wat10 .0049 .25 .2577 .037 |
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Wat11 .1247 .75 .0588 .047 |
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Wat12 .3209 .6587 -.0114 .073 |
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Wat13 .0710 .3409 .0103 .072 |
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| Download AMC data (View Text File)
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View JMOL 3-D Structure
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| |
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Heinrichite |
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Locock A J, Burns P C, Flynn T M |
|
The Canadian Mineralogist 43 (2005) 721-733 |
|
Structures of strontium- and barium-dominant compounds that contain the autunite-type sheet |
|
7.1548 7.1340 21.290 90 104.171 90 P2/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) |
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U .2861 .7488 .0440 .013 .012 .011 .015 0 .003 0 |
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As .2462 .2486 .0011 .014 .012 .011 .019 0 .004 0 |
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Ba .5 -.0417 .25 .024 .025 .025 .020 0 .003 0 |
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O1 .3520 .7528 .1308 .019 .022 .015 .021 .002 .004 0 |
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O2 .3200 .4323 .0502 .022 .032 .011 .020 -.004 .003 -.004 |
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O3 .2436 .0635 .0497 .021 .027 .011 .027 0 .011 .004 |
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O4 .3966 .2112 -.0469 .019 .012 .024 .024 -.003 .009 -.002 |
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O5 .0284 .2857 -.0477 .021 .014 .026 .025 -.001 .005 .002 |
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O6 .2234 .7473 -.0418 .024 .027 .028 .018 .001 .007 .001 |
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Wat7 .1406 .1012 .1747 .043 .033 .049 .047 .007 .009 -.005 |
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Wat8 .7529 -.0049 .1623 .043 .051 .048 .032 -.015 .015 -.002 |
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Wat9 .5252 .3046 .1772 .048 .063 .035 .038 -.003 0 .001 |
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Wat10 .2806 .6324 .2615 .043 .041 .048 .039 -.009 .008 -.004 |
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Wat11 .0189 .5071 .3373 .051 .064 .061 .031 .015 .015 .009 |
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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
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| |
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Meta-uranocircite I |
|
Locock A J, Burns P C, Flynn T M |
|
The Canadian Mineralogist 43 (2005) 721-733 |
|
Structures of strontium- and barium-dominant compounds that contain the autunite-type sheet |
|
6.943 17.634 6.952 90 90.023 90 P2_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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U1 .5350 .0711 .5464 .012 .009 .017 .009 0 -.001 0 |
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U2 .0412 .1665 .0404 .011 .006 .018 .010 0 -.002 0 |
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Ba .3984 .3399 .1804 .027 .023 .033 .024 -.007 -.001 -.005 |
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P1 .0362 .1180 -.4591 .013 .007 .022 .009 0 -.001 .001 |
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P2 .5348 .1203 .0518 .013 .007 .020 .012 -.001 0 0 |
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O1 .5360 .1725 .5350 .026 |
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O2 .0440 .0670 .0420 .020 |
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O3 .4893 .0768 .8716 .019 |
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O4 .5690 .0670 .2186 .013 |
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O5 .2107 .0676 -.4911 .016 |
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O6 -.2830 .1714 .0200 .021 |
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O7 -.1406 .0700 -.4252 .019 |
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O8 .0660 .1732 -.2850 .023 |
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O9 .0062 .1716 -.6330 .020 |
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O10 .3674 .1773 .0969 .013 |
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O11 .5380 -.0295 .5616 .016 |
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O12 .0480 .2694 .0400 .017 |
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Wat13 .2560 .3072 .5540 .040 |
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Wat14 .6930 .4329 .0570 .037 |
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Wat15 .7520 .3109 .3880 .033 |
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Wat16 .2420 .4226 -.1380 .042 |
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Wat17 -.0520 -.0803 -.2660 .030 |
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Wat18 .5800 .3029 -.1760 .044 |
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Wat19 .1390 -.0770 -.7100 .049 |
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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
|
| |
|
Metauranocircite I |
|
Locock A J, Burns P C, Flynn T M |
|
The Canadian Mineralogist 43 (2005) 721-733 |
|
Structures of strontium- and barium-dominant compounds that contain the autunite-type sheet |
|
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) |
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U1 .5350 .0711 .5464 .012 .009 .017 .009 0 -.001 0 |
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U2 .0412 .1665 .0404 .011 .006 .018 .010 0 -.002 0 |
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Ba .3984 .3399 .1804 .027 .023 .033 .024 -.007 -.001 -.005 |
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P1 .0362 .1180 -.4591 .013 .007 .022 .009 0 -.001 .001 |
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P2 .5348 .1203 .0518 .013 .007 .020 .012 -.001 0 0 |
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O1 .5360 .1725 .5350 .026 |
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O2 .0440 .0670 .0420 .020 |
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O3 .4893 .0768 .8716 .019 |
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O4 .5690 .0670 .2186 .013 |
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O5 .2107 .0676 -.4911 .016 |
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O6 -.2830 .1714 .0200 .021 |
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O7 -.1406 .0700 -.4252 .019 |
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O8 .0660 .1732 -.2850 .023 |
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O9 .0062 .1716 -.6330 .020 |
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O10 .3674 .1773 .0969 .013 |
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O11 .5380 -.0295 .5616 .016 |
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O12 .0480 .2694 .0400 .017 |
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Wat13 .2560 .3072 .5540 .040 |
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Wat14 .6930 .4329 .0570 .037 |
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Wat15 .7520 .3109 .3880 .033 |
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Wat16 .2420 .4226 -.1380 .042 |
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Wat17 -.0520 -.0803 -.2660 .030 |
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Wat18 .5800 .3029 -.1760 .044 |
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Wat19 .1390 -.0770 -.7100 .049 |
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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
|
| |
|
Metauranocircite II |
| |
Locock A J, Burns P C, Flynn T M |
|
The Canadian Mineralogist 43 (2005) 721-733 |
|
Structures of strontium- and barium-dominant compounds that contain the autunite-type sheet |
|
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) |
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U1 -.50710 -.79811 .73137 .0146 .0144 .0146 .0148 .0000 -.0022 -.0018 |
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U2 -.00705 -.69617 .72978 .0147 .0154 .0152 .0133 .0005 -.0004 .0015 |
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Ba -.82940 -.94228 .87402 .0348 .0344 .0247 .0451 -.0028 .0011 .0013 |
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P1 -.7622 -.7576 .4757 .018 |
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P2 -.2579 -.7585 .4799 .018 |
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O1 -.5174 -.9050 .7406 .025 |
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O2 -.5096 -.6951 .7141 .023 |
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O3 -.0114 -.5934 .7071 .035 |
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O4 -.9919 -.8019 .7502 .022 |
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O5 -.8583 -.8168 .4041 .023 |
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O6 -.8420 -.7029 .5640 .038 |
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O7 -.6630 -.8026 .5574 .022 |
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O8 -.7014 -.7066 .3665 .038 |
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O9 -.1591 -.7016 .5496 .042 |
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O10 -.3621 -.7074 .4025 .029 |
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O11 -.1823 -.8115 .3763 .033 |
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Wat13 -.3348 -.8109 .5834 .010 |
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Wat14 -.1185 -.9415 .9197 .038 |
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Wat15 -.8972 -.9462 .5905 .046 |
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Wat16 -.6089 -.9526 .0658 .073 |
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Wat17 -.6752 -.0513 .7361 .055 |
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Wat18 -.5784 -.9546 .4132 .047 |
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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
|
| |
|
Meta-uranocircite II |
| |
Locock A J, Burns P C, Flynn T M |
|
The Canadian Mineralogist 43 (2005) 721-733 |
|
Structures of strontium- and barium-dominant compounds that contain the autunite-type sheet |
|
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 |
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P1 -.7622 -.7576 .4757 .018 |
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P2 -.2579 -.7585 .4799 .018 |
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O1 -.5174 -.9050 .7406 .025 |
|
O2 -.5096 -.6951 .7141 .023 |
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O3 -.0114 -.5934 .7071 .035 |
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O4 -.9919 -.8019 .7502 .022 |
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O5 -.8583 -.8168 .4041 .023 |
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O6 -.8420 -.7029 .5640 .038 |
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O7 -.6630 -.8026 .5574 .022 |
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O8 -.7014 -.7066 .3665 .038 |
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O9 -.1591 -.7016 .5496 .042 |
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O10 -.3621 -.7074 .4025 .029 |
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O11 -.1823 -.8115 .3763 .033 |
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Wat13 -.3348 -.8109 .5834 .010 |
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Wat14 -.1185 -.9415 .9197 .038 |
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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
|
| |
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