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Ca9Nd(PO4)5(SiO4)F1.5O.25 |
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Boyer L, Savariault J M, Carpena J, Lacout J L |
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Acta Crystallographica C54 (1998) 1057-1059 |
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A neodymium-substituted britholite compound |
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Locality: synthetic |
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_database_code_amcsd 0010315 |
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9.3938 9.3938 6.9013 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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Ca1 1/3 2/3 .00051 .96 .01174 .01398 .01398 .0073 .00699 0 0 |
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Nd1 1/3 2/3 .00051 .04 .01174 .01398 .01398 .0073 .00699 0 0 |
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Ca2 .23845 .99067 .25 .86 .01068 .01385 .00999 .00830 .00603 0 0 |
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Nd2 .23845 .99067 .25 .14 .01068 .01385 .00999 .00830 .00603 0 0 |
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P .39748 .36879 .25 .85 .00679 .0079 .0070 .0064 .0044 0 0 |
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Si .39748 .36879 .25 .15 .00679 .0079 .0070 .0064 .0044 0 0 |
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O1 .3249 .4845 .25 .0149 .0087 .0108 .0239 .0039 0 0 |
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O2 .5878 .4667 .25 .0176 .0305 .0156 .0111 .0149 -.0089 -.0053 |
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O3 .3413 .2561 .0701 .017 .017 .017 .02 .008 0 0 |
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O4 0 0 .298 .07 .0127 .0177 .0124 .0129 .0112 0 0 |
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F 0 0 .25 .77 .017 .011 .011 .029 .0053 0 0 |
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