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Priceite |
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Wallwork K S, Pring A, Taylor M R, Hunter B A |
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The Canadian Mineralogist 40 (2002) 1199-1206 |
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The structure of priceite, a basic hydrated calcium borate, |
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by ab initio powder-diffraction methods |
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11.623 6.976 12.350 90 110.70 90 P2_1/c |
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atom x y z Uiso |
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Ca1 .4928 .2403 -.0809 .017 |
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Ca2 .8085 .2554 .3790 .017 |
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O1 .1817 .2579 .2235 .013 |
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OH2 .7956 .5805 .4357 .013 |
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O3 .7671 .9288 .4186 .013 |
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O4 .6167 -.2127 -.2116 .013 |
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OH5 .5208 .1072 .1129 .013 |
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OH6 .4088 .8312 .2247 .013 |
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O7 .5527 .9347 .4069 .013 |
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O8 .7145 .8283 .5805 .013 |
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O9 .6999 .3331 .0234 .013 |
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OH10 .7709 .1081 .1825 .013 |
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OH11 .9088 .2410 .0914 .013 |
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O12 .8317 .4375 .2145 .013 |
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Wat13 .0112 .1530 .4003 .013 |
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B1 .7497 -.2543 -.6451 .015 |
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B2 .5139 -.2715 -.1731 .015 |
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B3 .6835 -.0350 -.5180 .015 |
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B4 .8029 .2799 .1280 .015 |
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B5 .7882 -.1241 -.3089 .015 |
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