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Malayaite |
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Zhang M, Meyer H W, Groat L A, Bismayer U, Salje E K H, Adiwidjaja G |
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Physics and Chemistry of Minerals 26 (1999) 546-553 |
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An infrared spectroscopic and single-crystal X-ray study |
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of malayaite, CaSnSiO5 |
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Sample: T = 300 K |
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_database_code_amcsd 0008233 |
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7.156 8.875 6.660 90 113.38 90 A2/a |
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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 .25 .66268 .5 .0184 .03403 .00510 .00686 0 -.00125 0 |
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Sn .5 .5 0 .0042 .00365 .00495 .00348 .00000 .00126 .00000 |
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Si 3/4 .6819 .5 .0050 .00534 .00498 .00394 0 .00156 0 |
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O1 3/4 .5869 0 .0078 .00424 .00614 .01369 0 .00539 0 |
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O2 .9132 .5678 .6751 .0078 .00825 .00862 .00500 .00237 .00148 .00147 |
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O3 .3718 .71225 .8810 .0068 .00855 .00650 .00740 .00260 .00454 .00063 |
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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 (permalink)
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