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Satterlyite |
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Kolitsch U, Andrut M, Giester G |
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European Journal of Mineralogy 14 (2002) 127-133 |
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Satterlyite, (Fe,Mg)12(PO3OH)(PO4)5(OH,O)6: crystal structure |
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and infrared absorption spectra |
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Note: z-coordinate of O6 altered by author, August 2003. |
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_database_code_amcsd 0006926 |
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11.355 11.355 5.0394 90 90 120 P31m |
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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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FeM1 .32918 .85077 .01101 .838 .01032 .00807 .01038 .00916 .00211 .00059 -.00229 |
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MgM1 .32918 .85077 .01101 .162 .01032 .00807 .01038 .00916 .00211 .00059 -.00229 |
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FeM2 .17508 .85376 .50440 .706 .0087 .00898 .0079 .00909 .00413 -.00001 .00038 |
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MgM2 .17508 .85376 .50440 .294 .0087 .00898 .0079 .00909 .00413 -.00001 .00038 |
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P1 0 0 .27825 .00745 .0069 .0069 .0085 .00345 0 0 |
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P2 1/3 2/3 .52733 .00671 .00744 .00744 .0052 .0026 0 0 |
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P3 .34138 .34138 .97775 .00676 .00686 .00686 .0068 .00362 -.00074 -.00074 |
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O1 .87239 .87239 .3697 .0192 .0090 .0090 .0377 .0029 .0058 .0058 |
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O2 .27631 .75462 .6355 .01207 .0152 .0130 .0126 .0105 -.0010 -.0013 |
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O3 .26833 .26833 .7203 .0119 .0137 .0137 .0118 .0096 -.0053 -.0053 |
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O4 .12718 .75025 .1427 .0120 .0085 .0150 .0094 .0035 -.0018 -.0016 |
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O5 .47330 .47330 .9051 .0134 .0095 .0095 .0170 .0015 .0004 .0004 |
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O6 1/3 2/3 .2187 .0162 .0213 .0213 .0060 .01065 0 0 |
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Oh1 .62619 .62619 .3250 .0112 .0121 .0121 .0082 .0052 -.0002 -.0002 |
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Oh2 .72336 .72336 .8162 .0116 .0127 .0127 .0100 .0069 -.0028 -.0028 |
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Oh3 0 0 -.0305 .0397 .0549 .0549 .0095 .02745 0 0 |
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H1 .563 .563 .416 .0240 |
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H2 .805 .805 .904 .0210 |
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