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Manandonite |
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Zheng H, Bailey S W |
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American Mineralogist 80 (1995) 387-393 |
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The crystal structure of manandonite-2H2 |
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_database_code_amcsd 0001732 |
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5.070 8.776 13.778 90.09 90.12 89.97 C1 |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Al1 .1693 .1705 .2250 .71 .0245 .0319 .0365 .0076 -.0026 .0018 |
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Li1 .1693 .1705 .2250 .29 .0245 .0319 .0365 .0076 -.0026 .0018 |
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Al2 .6770 .0003 .2256 .71 .0265 .0320 .0334 .0069 .0020 .0014 |
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Li2 .6770 .0003 .2256 .28 .0265 .0320 .0334 .0069 .0020 .0014 |
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Al3 .6739 .3347 .2247 .6 .0273 .0378 .0325 .0073 -.0011 -.0028 |
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Li3 .6739 .3347 .2247 .39 .0273 .0378 .0325 .0073 -.0011 -.0028 |
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Si1 .0120 .0002 .0298 .62 .0084 .0279 .0848 .0122 -.0057 -.0027 |
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Al4 .0120 .0002 .0298 .29 .0084 .0279 .0848 .0122 -.0057 -.0027 |
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B1 .0120 .0002 .0298 .09 .0084 .0279 .0848 .0122 -.0057 -.0027 |
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Si2 .0149 .3328 .0298 .4 .0303 .0470 .0558 .0063 -.0033 .0044 |
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Al2 .0149 .3328 .0298 .14 .0303 .0470 .0558 .0063 -.0033 .0044 |
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B2 .0149 .3328 .0298 .46 .0303 .0470 .0558 .0063 -.0033 .0044 |
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O1 .0099 .0006 .1506 .0201 .0347 .0377 .0043 -.0027 .0018 |
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O2 .0166 .3345 .1456 .0237 .0293 .0310 .0060 -.0025 .0000 |
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O3 .1109 .1703 -.0097 .0863 .0825 .0877 -.0081 .0055 .0109 |
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O4 .2106 .4612 -.0114 .0797 .0902 .0935 -.0005 -.0079 .0014 |
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O5 .2212 -.1332 -.0096 .1020 .0990 .0961 .0117 .0014 -.0067 |
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Oh1 .5106 .1632 .1498 .0235 .0347 .0354 .0069 -.0008 -.0016 |
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Oh2 .3458 .0099 .2936 .0381 .0343 .0234 .0055 .0003 -.0043 |
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Oh3 .3385 .3392 .2954 .0338 .0298 .0245 .0093 -.0006 .0008 |
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Oh4 .8489 .1665 .2977 .0300 .0415 .0236 .0009 .0017 -.0034 |
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Al11 .3377 .3244 .7244 .58 .0187 .0331 .0372 .0160 -.0000 -.0038 |
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Li11 .3377 .3244 .7244 .41 .0187 .0331 .0372 .0160 -.0000 -.0038 |
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Al22 -.1612 .4972 .7261 .72 .0192 .0285 .0299 .0127 -.0036 .0004 |
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Li22 -.1612 .4972 .7261 .28 .0192 .0285 .0299 .0127 -.0036 .0004 |
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Al33 -.1556 .1633 .7265 .73 .0173 .0282 .0296 .0144 .0019 .0004 |
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Li33 -.1556 .1633 .7265 .26 .0173 .0282 .0296 .0144 .0019 .0004 |
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Si11 .0131 -.0011 .5305 .6 .0367 .0453 .0671 .0128 -.0064 .0049 |
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Al11 .0131 -.0011 .5305 .27 .0367 .0453 .0671 .0128 -.0064 .0049 |
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B11 .0131 -.0011 .5305 .13 .0367 .0453 .0671 .0128 -.0064 .0049 |
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Si22 -.4889 .1630 .5304 .41 .0249 .0337 .0700 .0162 -.0079 .0014 |
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Al22 -.4889 .1630 .5304 .15 .0249 .0337 .0700 .0162 -.0079 .0014 |
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B22 -.4889 .1630 .5304 .44 .0249 .0337 .0700 .0162 -.0079 .0014 |
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O11 .0218 .0044 .6517 .0576 .0585 .0499 .0077 -.0006 -.0024 |
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O22 -.4891 .1563 .6464 .0501 .0488 .0448 .0068 .0004 -.0016 |
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O33 .3134 .0367 .4874 .0948 .0926 .0970 -.0014 .0042 -.0032 |
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O44 -.5873 .3272 .4948 .1088 .1015 .1057 .0033 -.0082 -.0019 |
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O55 -.1970 .1310 .4907 .1067 .1118 .1066 .0031 .0032 .0062 |
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Oh11 .0032 .3302 .6500 .0503 .0400 .0382 .0072 .0010 .0004 |
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Oh22 -.3176 .3230 .7943 .0255 .0304 .0275 .0109 .0022 .0033 |
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Oh33 .1619 .4945 .7945 .0254 .0409 .0234 .0045 -.0031 .0054 |
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Oh44 .1686 .1556 .7996 .0239 .0313 .0289 .0076 .0000 .0005 |
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H1 .5271 .1890 .0894 |
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H2 .3193 .0192 .3589 |
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H3 .3639 .3464 .3606 |
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H4 .8268 .1550 .3621 |
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H11 .9866 .3046 .5903 |
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H22 .6961 .3379 .8601 |
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H33 .6895 .9835 .8598 |
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H44 .1443 .1645 .8648 |
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Cookeite |
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Zheng H, Bailey S W |
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American Mineralogist 82 (1997) 1007-1013 |
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Refinement of the cookeite "r" structure |
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_database_code_amcsd 0001949 |
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5.158 8.940 28.498 90 96.6 90 Cc |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Al1 .4916 .5004 .0001 .0024 .0029 .0096 -.0003 .0015 .0005 |
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Al2 .4896 .8368 .0000 .0146 .0144 .0175 .0002 .0022 -.0002 |
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Al3 .5017 -.0051 .2502 .91 .0165 .0165 .0186 .0000 .0022 .0000 |
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Li3 .5017 -.0051 .2502 .09 .0165 .0165 .0186 .0000 .0022 .0000 |
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Al4 .5023 .3243 .2502 .91 .0107 .0105 .0139 .0003 .0020 .0000 |
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Li4 .5023 .3243 .2502 .09 .0107 .0105 .0139 .0003 .0020 .0000 |
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Li .5005 .6681 .2509 .68 .0070 .0069 .0069 -.0001 .0007 .0000 |
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Al .5005 .6681 .2509 .21 .0070 .0069 .0069 -.0001 .0007 .0000 |
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Si1 .3885 -.0114 .0959 .85 .0139 .0142 .0184 -.0002 .0026 -.0002 |
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Al1 .3885 -.0114 .0959 .15 .0139 .0142 .0184 -.0002 .0026 -.0002 |
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Si2 .4001 .6570 .0956 .85 .0102 .0100 .0152 -.0009 .0023 -.0001 |
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Al2 .4001 .6570 .0956 .15 .0102 .0100 .0152 -.0009 .0023 -.0001 |
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Si3 .5868 .3282 .4048 .85 .0293 .0293 .0311 .0006 .0037 -.0004 |
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Al3 .5868 .3282 .4048 .15 .0293 .0293 .0311 .0006 .0037 -.0004 |
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Si4 .5954 .6580 .4041 .49 .0021 .0024 .0098 .0005 .0021 .0000 |
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Al4 .5954 .6580 .4041 .51 .0021 .0024 .0098 .0005 .0021 .0000 |
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H1 .3865 .3174 .0675 |
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H2 .5354 -.0015 .4355 |
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H3 .1305 -.0108 .1816 |
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H4 .1398 .3383 .1787 |
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H5 .1056 .6578 .1810 |
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H6 .3776 .1839 .3198 |
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H7 .3761 .4885 .3186 |
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H8 .3661 .8387 .3220 |
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O1 .1127 .6158 .1130 .0371 .0372 .0375 .0001 .0045 -.0001 |
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O2 .4818 .8234 .1184 .0220 .0221 .0226 .0000 .0026 .0007 |
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O3 .6277 .5417 .1203 .0232 .0233 .0238 .0000 .0029 .0001 |
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O4 .3203 -.0261 .0381 .0173 .0175 .0182 -.0001 .0022 .0000 |
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O5 .4050 .6684 .0378 .0220 .0222 .0227 .0000 .0027 .0000 |
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O6 .3649 .2095 .3799 .0227 .0230 .0234 .0000 .0028 -.0001 |
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O7 .5112 .4910 .3791 .0283 .0283 .0289 .0000 .0032 .0001 |
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O8 .8632 .2822 .3839 .0261 .0264 .0269 .0000 .0033 .0000 |
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O9 .5840 .3319 .4631 .0033 .0039 .0051 .0003 .0010 .0001 |
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O10 .6555 .6424 .4631 .0097 .0097 .0106 -.0001 .0015 .0002 |
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Oh1 .3243 .3586 .0373 .0074 .0069 .0083 .0002 .0010 -.0001 |
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Oh2 .6567 .0197 .4628 .0054 .0055 .0065 -.0003 .0011 .0000 |
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Oh3 .1528 -.0150 .2157 .0204 .0204 .0206 -.0002 .0022 .0000 |
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Oh4 .1604 .3429 .2142 .0082 .0084 .0090 .0001 .0009 .0000 |
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Oh5 .1230 .6595 .2138 .0089 .0085 .0092 .0001 .0013 -.0001 |
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Oh6 .3820 .1594 .2868 .0164 .0164 .0169 -.0001 .0021 -.0001 |
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Oh7 .3497 .4827 .2849 .0345 .0346 .0347 .0001 .0041 .0000 |
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Oh8 .3409 .8452 .2872 .0283 .0282 .0285 .0000 .0033 .0001 |
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| Download AMC data (View Text File)
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View JMOL 3-D Structure
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Nacrite |
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Zheng H, Bailey S W |
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Clays and Clay Minerals 42 (1994) 46-52 |
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Refinement of the nacrite structure |
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Locality: Red Mountain near Silverton, Colorado, USA |
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_database_code_amcsd 0012238 |
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8.906 5.146 15.664 90 113.58 90 Cc |
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atom x y z B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Al1 .1552 .3198 .2177 .0034 .0090 .0017 .0000 .0012 -.0002 |
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Al2 .4901 .3245 .2173 .0033 .0082 .0021 -.0003 .0016 -.0002 |
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Sil .2012 .4700 .0277 .0034 .0052 .0021 -.0001 .0016 .0000 |
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Si2 .3715 .9831 .0270 .0036 .0065 .0017 -.0002 .0013 -.0001 |
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O1 .2411 .7499 -.0041 .0047 .0097 .0023 .0028 .0014 .0005 |
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O2 .2723 .2470 -.0188 .0053 .0080 .0023 -.0013 .0019 .0000 |
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O3 .0029 .4417 -.0193 .0034 .0124 .0019 -.0004 .0012 .0003 |
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O4 .2696 .4385 .1385 .0021 .0047 .0024 -.0004 .0014 -.0001 |
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O5 .4618 .0110 .1381 .0040 .0115 .0020 -.0026 .0014 .0004 |
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Oh1 .0795 .0118 .1432 .0053 .0095 .0023 .0024 .0021 .0006 |
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Oh2 .5580 .6342 .2838 .0054 .0118 .0020 -.0016 .0018 .0000 |
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Oh3 .1780 .6296 .2825 .0043 .0099 .0019 .0007 .0012 .0000 |
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Oh4 .3693 .2066 .2826 .0049 .0154 .0016 -.0010 .0013 -.0010 |
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H1 .6346 .4510 .1277 |
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H2 .5475 .6736 .3279 |
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H3 .2432 .6096 .3296 |
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H4 .4317 .1386 .3228 |
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| Download AMC data (View Text File)
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View JMOL 3-D Structure
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Amesite |
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Zheng H, Bailey S W |
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Clays and Clay Minerals 45 (1997) 301-310 |
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Refinement of an amesite-2H1 polytype from Postmasburg, South Africa |
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Note: polytype 2H1 |
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Locality: Postmasburg, South Africa |
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_database_code_amcsd 0018811 |
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5.299 9.181 14.050 90.06 90.30 90.00 C1 |
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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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MgM1 .1699 .1695 .2341 .87 .0076 .007 .007 .009 -.0012 .0005 .0006 |
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AlM1 .1699 .1695 .2341 .13 .0076 .007 .007 .009 -.0012 .0005 .0006 |
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AlM2 .6663 .0007 .2341 .62 .0092 .008 .008 .011 -.0017 .0004 .0007 |
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MgM2 .6663 .0007 .2341 .38 .0092 .008 .008 .011 -.0017 .0004 .0007 |
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MgM3 .6697 .3322 .2345 .85 .0082 .007 .007 .010 -.0013 .0006 .0007 |
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AlM3 .6697 .3322 .2345 .15 .0082 .007 .007 .010 -.0013 .0006 .0007 |
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SiT1 .5000 .1667 .0383 .72 .0084 .007 .007 .011 -.0031 .0012 .0008 |
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AlT1 .5000 .1667 .0383 .28 .0084 .007 .007 .011 -.0031 .0012 .0008 |
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AlT2 .0012 .3360 .0388 .72 .011 .009 .010 .013 -.0035 .0010 .0010 |
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SiT2 .0012 .3360 .0388 .28 .011 .009 .010 .013 -.0035 .0010 .0010 |
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O1 .497 .1632 .1582 .008 .007 .007 .008 -.001 .000 .000 |
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O2 -.003 .3375 .1614 .011 .010 .011 .011 .000 .000 .000 |
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O3 .584 .0036 -.0023 .016 .016 .016 .017 .000 .001 .000 |
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O4 .215 .212 -.0036 .016 .016 .016 .017 -.001 .000 .001 |
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O5 .707 .292 .0017 .020 .020 .020 .021 -.001 .000 .001 |
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Oh1 -.011 -.001 .1615 .011 .011 .011 .012 .000 .000 .000 |
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Oh2 .330 -.003 .3030 .024 .0242 .0245 .0239 .000 .000 .000 |
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Oh3 .326 .336 .3029 .022 .022 .023 .022 .000 .000 .000 |
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Oh4 -.173 .159 .303 .018 .018 .018 .017 .000 .000 .000 |
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AlM11 .3406 .3348 .7342 .50 .0081 .008 .007 .010 -.0019 .0004 .0005 |
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MgM11 .3406 .3348 .7342 .50 .0081 .008 .007 .010 -.0019 .0004 .0005 |
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MgM22 .3430 .0030 .7345 .90 .0089 .007 .009 .010 -.0015 -.0002 .0007 |
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AlM22 .3430 .0030 .7345 .10 .0089 .007 .009 .010 -.0015 -.0002 .0007 |
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AlM33 .8409 .1706 .7343 .50 .0081 .007 .007 .010 -.0022 .0004 .0003 |
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MgM33 .8409 .1706 .7343 .50 .0081 .007 .007 .010 -.0022 .0004 .0003 |
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AlT11 .5097 .1706 .5390 .72 .012 .012 .011 .014 -.0032 .0010 .0010 |
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SiT11 .5097 .1706 .5390 .28 .012 .012 .011 .014 -.0032 .0010 .0010 |
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SiT22 .0083 .3344 .5386 .72 .010 .010 .010 .012 -.0021 .0006 .0005 |
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AlT22 .0083 .3344 .5386 .28 .010 .010 .010 .012 -.0021 .0006 .0005 |
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Oll .519 .178 .662 .012 .012 .011 .012 -.002 .000 .001 |
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O22 .018 .333 .6581 .014 .013 .014 .014 .000 .000 .000 |
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O33 .429 .0003 .5001 .014 .014 .014 .015 .000 .000 .001 |
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O44 .290 .290 .4960 .015 .015 .015 .016 .000 .000 .000 |
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O55 .799 .213 .4972 .022 .022 .022 .022 .000 .000 .000 |
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Ohll .007 .004 .6627 .013 .013 .014 .014 .000 .000 .000 |
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Oh22 .179 .177 .8037 .019 .019 .019 .019 .000 .000 .000 |
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Oh33 .191 .505 .8040 .015 .015 .015 .015 -.001 .000 .000 |
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Oh44 .677 .333 .8047 .018 .018 .018 .017 -.001 .000 .000 |
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H1 .984 .998 .089 |
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H2 .353 .969 .371 |
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H3 .308 .325 .374 |
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H4 .846 .169 .378 |
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H11 .006 .004 .588 |
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H22 .190 .197 .876 |
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H33 .162 .505 .878 |
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H44 .685 .315 .876 |
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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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