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Sr5(AsO4)3F |
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Dordevic T, Sutovic S, Stojanovic J, Karanovic L |
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Acta Crystallographica C64 (2008) i82-i86 |
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Sr, Ba and Cd arsenates with the apatite-type structure |
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Locality: synthetic |
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_database_code_amcsd 0010344 |
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9.990 9.990 7.395 90 90 120 P6_3/m |
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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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Sr1 1/3 2/3 .00132 .01060 .0126 .0126 .0067 .00628 0 0 |
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Sr2 .23777 .98886 .25 .01059 .0121 .0095 .0096 .00497 0 0 |
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As .40023 .37000 .25 .00793 .0086 .0081 .0077 .00463 0 0 |
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O1 .3236 .4861 .25 .0138 .0193 .0125 .0158 .0124 0 0 |
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O2 .5940 .4701 .25 .0159 .0090 .0115 .0262 .0043 0 0 |
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O3 .3438 .2541 .0688 .0202 .0365 .0164 .0127 .0170 -.0120 -.0074 |
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F 0 0 .25 .0387 .0163 .0163 .083 .0082 0 0 |
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Morelandite |
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Dordevic T, Sutovic S, Stojanovic J, Karanovic L |
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Acta Crystallographica C64 (2008) i82-i86 |
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Sr, Ba and Cd arsenates with the apatite-type structure |
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Locality: synthetic |
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_database_code_amcsd 0010345 |
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10.390 10.390 7.575 90 90 120 P6_3/m |
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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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Sr1 1/3 2/3 .00205 .830 .0177 .0196 .0196 .0138 .00981 0 0 |
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Ba1 1/3 2/3 .00205 .169 .0177 .0196 .0196 .0138 .00981 0 0 |
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Ba2 .24448 .98591 .25 .871 .0174 .0178 .0183 .0161 .0090 0 0 |
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Sr2 .24448 .98591 .25 .129 .0174 .0178 .0183 .0161 .0090 0 0 |
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As .41242 .37889 .25 .0143 .0139 .0130 .0158 .0066 0 0 |
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O1 .3507 .5015 .25 .0267 .038 .028 .026 .025 0 0 |
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O2 .5991 .4661 .25 .0323 .017 .020 .064 .012 0 0 |
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O3 .3574 .2700 .0719 .0445 .075 .035 .033 .034 -.033 -.022 |
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Cl 0 0 0 .0276 .0305 .0305 .0219 .0153 0 0 |
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Cd5(AsO4)3Cl.58(OH).42 |
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Dordevic T, Sutovic S, Stojanovic J, Karanovic L |
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Acta Crystallographica C64 (2008) i82-i86 |
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Sr, Ba and Cd arsenates with the apatite-type structure |
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Locality: synthetic |
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_database_code_amcsd 0010346 |
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9.971 9.971 6.514 90 90 120 P6_3/m |
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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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Cd1 1/3 2/3 .00216 .01110 .0135 .0135 .0063 .00675 0 0 |
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Cd2 .26495 .02676 .25 .01741 .0285 .0109 .0087 .0067 0 0 |
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As .40361 .37911 .25 .00749 .0083 .0078 .0076 .0050 0 0 |
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Cl 0 0 .25 .58 .0247 .0106 .0106 .053 .0053 0 0 |
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O4 0 0 .25 .42 .0247 .0106 .0106 .053 .0053 0 0 |
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H 0 0 .113 .210 .030 |
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O1 .3511 .5125 .25 .0125 .023 .012 .010 .013 0 0 |
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O2 .6004 .4623 .25 .0126 .008 .010 .015 .0014 0 0 |
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O3 .3412 .2579 .0471 .0151 .0249 .0106 .0111 .0098 -.0070 -.0042 |
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Elpidite |
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Grigor'eva A A, Zubkova N V, Pekov I V, Kolitsch U, Pushcharovsky D Y, |
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Vigasina M F, Giester G,Dordevic T, Tillmanns E, Chukanov N V |
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Crystallography Reports 56 (2011) 832-841 |
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Crystal chemistry of elpidite from Kahn Bogdo (Mongolia) |
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and its K- and Rb-exchanged forms |
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Locality: Kahn Bogdo, Mongolia |
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_database_code_amcsd 0018522 |
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7.1312 14.6853 14.6349 90 90 90 Pbcm |
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atom x y z occ Uiso |
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Na(1) .4449 .23175 .75 .0477 |
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Na(2) -.00275 .25 .5 .0151 |
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Zr .49658 .25 .5 .00804 |
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Si(1) .77343 .38628 .64604 .01028 |
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Si(2) .50598 .04735 .64184 .01005 |
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Si(3) .21944 .39130 .64439 .01016 |
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O(1) .99571 .40384 .63913 .0179 |
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O(2) .7195 .35610 .75 .0183 |
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O(3) .7095 .30908 .57729 .0178 |
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O(4) .6779 .48448 .62422 .0195 |
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O(5) .5210 .07108 .75 .0192 |
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O(6) .49255 .14009 .58783 .0177 |
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O(7) .3072 .48949 .61315 .0167 |
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O(8) .2826 .37415 .75 .0177 |
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O(9) .2893 .30986 .58199 .0174 |
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Wat(1) .0080 .11320 .58101 .0344 |
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Wat(2) .1213 .1883 .75 .0650 |
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| Download AMC data (View Text File)
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View JMOL 3-D Structure
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Elpidite |
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Grigor'eva A A, Zubkova N V, Pekov I V, Kolitsch U, Pushcharovsky D Y, |
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Vigasina M F, Giester G,Dordevic T, Tillmanns E, Chukanov N V |
| |
Crystallography Reports 56 (2011) 832-841 |
|
Crystal chemistry of elpidite from Kahn Bogdo (Mongolia) |
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and its K- and Rb-exchanged forms |
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Locality: Kahn Bogdo, Mongolia |
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Note: Rb-exchanged at 90 deg C |
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_database_code_amcsd 0018523 |
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7.1280 14.644 14.642 90 90 90 Pbcm |
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atom x y z occ Uiso |
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Na(1) .4421 .2315 .75 .661 .0343 |
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Na(2) -.0029 .25 .5 .920 .0250 |
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Rb -.004 .1410 .5789 .10 .037 |
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Zr .49697 .25 .5 .00939 |
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Si(1) .77407 .38617 .64615 .0132 |
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Si(2) .50553 .04747 .64216 .0124 |
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Si(3) .21932 .39087 .64457 .0128 |
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O(1) .9961 .4040 .6383 .0242 |
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O(2) .7207 .3560 .75 .0226 |
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O(3) .7092 .3091 .5775 .0221 |
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O(4) .6782 .4846 .6250 .0232 |
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O(5) .5181 .0727 .75 .0219 |
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O(6) .4929 .1395 .5872 .0237 |
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O(7) .3086 .4892 .6148 .0221 |
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O(8) .2808 .3723 .75 .0225 |
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O(9) .2897 .3097 .5816 .0218 |
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Wat(1) .0088 .1145 .5805 .91 .0257 |
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Wat(2) .1251 .1869 .75 .67 .047 |
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Wat(3) .014 .176 .797 .10 .040 |
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View JMOL 3-D Structure
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Elpidite-Rb |
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Grigor'eva A A, Zubkova N V, Pekov I V, Kolitsch U, Pushcharovsky D Y, |
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Vigasina M F, Giester G,Dordevic T, Tillmanns E, Chukanov N V |
| |
Crystallography Reports 56 (2011) 832-841 |
|
Crystal chemistry of elpidite from Kahn Bogdo (Mongolia) |
|
and its K- and Rb-exchanged forms |
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Locality: Kahn Bogdo, Mongolia |
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Note: Rb-exchanged at 150 deg C |
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_database_code_amcsd 0018524 |
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14.2999 14.4408 14.7690 90 90 90 Cmca |
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atom x y z occ Uiso |
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Rb(1) .5 .2509 .5093 .079 .035 |
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Rb(2) .5 .13663 .58254 .75 .0340 |
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Rb(3) .0 .3638 .07055 .61 .0377 |
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Rb(4) .0 .386 .0733 .22 .073 |
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Rb(5) .5 .1391 .597 .11 .099 |
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Na .25 .236 .75 .06 .067 |
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Zr .25 .25 .5 .01018 |
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Si(1) .39070 .10779 .36275 .01381 |
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Si(2) .38954 .38148 .65364 .01386 |
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Si(3) .24382 .04903 .64483 .01324 |
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O(1) .1522 .1960 .40971 .0254 |
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O(2) .1521 .01643 .3665 .0249 |
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O(3) .25 .0803 .75 .0270 |
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O(4) .2332 .13556 .58132 .0253 |
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O(5) .0 .1084 .3670 .0296 |
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O(6) .3371 -.0103 .6221 .0249 |
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O(7) .3751 .3566 .75949 .0280 |
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O(8) .3624 .1858 .43343 .0223 |
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O(9) .5 .0790 .3775 .0244 |
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Wat(1) .0648 .3294 .2436 .404 .043 |
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Wat(2) .0 .190 .733 .10 .041 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
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View JMOL 3-D Structure
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