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CaK2P2O7 |
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Sandstrom M, Fischer A, Bostrom D |
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Acta Crystallographica E59 (2003) i139-i141 |
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CaK2P2O7 |
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_database_code_amcsd 0010413 |
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9.8180 5.6760 13.0060 90 104.220 90 P2_1/n |
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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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Ca .25171 .23853 .51853 .00852 .00860 .00917 .00784 -.00006 .00212 -.00006 |
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K1 .64355 .73001 .17826 .01786 .01652 .01471 .0235 .00157 .00707 -.00086 |
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K2 .12771 .23766 .14143 .02614 .01418 .01741 .0477 .00060 .00924 .00472 |
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P1 .53029 .24480 .35836 .00791 .00845 .00860 .00708 .00028 .00266 -.00060 |
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P2 .44736 .22007 .12604 .00866 .00877 .00927 .00759 .00049 .00132 .00003 |
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O1 .42978 .23579 .42959 .0181 .0200 .0218 .0166 .0027 .0127 .0020 |
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O2 .62764 .45501 .37887 .0171 .0152 .0124 .0229 -.0033 .0029 -.0056 |
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O3 .60418 .01248 .35197 .0125 .0135 .0104 .0134 .0025 .0032 .0008 |
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O4 .42554 .2964 .24223 .0145 .0122 .0221 .0089 .0062 .0016 -.0017 |
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O5 .39011 -.02855 .10984 .0186 .0187 .0124 .0214 -.0028 -.0014 -.0036 |
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O6 .60300 .23677 .13299 .0155 .0115 .0203 .0163 .0005 .0066 .0017 |
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O7 .35742 .3965 .05331 .0186 .0208 .0186 .0147 .0065 .0008 .0057 |
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CaKP3O9 |
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Sandstrom M, Bostrom D |
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Acta Crystallographica E60 (2004) i15-i17 |
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Calcium potassium cyclo-triphosphate |
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_database_code_amcsd 0010420 |
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6.8090 6.8090 10.3760 90 90 120 P-6c2 |
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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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Ca 1/3 2/3 0 .01396 .0153 .0153 .0113 .00765 0 0 |
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K 2/3 1/3 0 .0233 .0220 .0220 .0260 .01100 0 0 |
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P .73221 .96188 .75 .01192 .0098 .0124 .0140 .00589 0 0 |
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O1 .8054 .7734 .75 .0220 .0127 .0127 .0410 .0067 0 0 |
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O2 .6141 .9486 .87205 .0239 .0284 .0230 .0208 .0131 .0106 .0034 |
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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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