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Borax |
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Levy H A, Lisensky G C |
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Acta Crystallographica B34 (1978) 3502-3510 |
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Crystal structures of sodium sulfate decahydrate (Glauber's salt) and sodium |
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tetraborate decahydrate (borax). Redetermination by neutron diffraction |
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Locality: synthetic |
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Note: anisoU's from ICSD |
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11.885 10.654 12.206 90 106.623 90 C2/c |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Na1 0 0 0 .0251 .0298 .0254 .0001 .0053 .0020 |
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Na2 0 .8469 .25 .0288 .0316 .0289 0 .0132 0 |
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B1 .0853 .3452 .2151 .0141 .0165 .0142 .0021 .0047 -.0006 |
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B2 .0978 .4566 .3918 .0135 .0193 .0145 -.0026 .0044 -.0038 |
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O1 0 .2672 .25 .0189 .0146 .0152 0 .0037 0 |
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O2 .1544 .4194 .3146 .0157 .0251 .0184 -.0036 .0067 -.0055 |
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O3 .0194 .4346 .1243 .0159 .0256 .0200 .0040 .0075 .0083 |
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O4 .1614 .2712 .1679 .0206 .0328 .0227 .0082 .0060 -.0078 |
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O5 .1622 .5163 .4895 .0202 .0421 .0227 -.0104 .0078 -.0159 |
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O6 .1240 .8463 .4493 .0223 .0339 .0291 -.0009 .0048 .0028 |
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O7 .1233 .0009 .1956 .0243 .0263 .0332 -.0018 .0073 -.0008 |
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O8 .1197 .1647 .4615 .0293 .0360 .0291 .0005 .0055 .0096 |
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O9 .1171 .7049 .1718 .0324 .0321 .0354 .0001 .0050 -.0068 |
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H4 .7616 .2597 .2807 .0219 .0451 .0416 -.0058 .0047 .0060 |
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H5 .1127 .4589 .0379 .0354 .0468 .0291 .0057 .0127 .0128 |
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H6A .3003 .3857 .0367 .0332 .0497 .0511 .0050 .0106 -.0044 |
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H6B .8662 .2109 .4875 .0426 .0419 .0522 .0016 .0144 .0117 |
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H7A .2984 .4755 .3064 .0322 .0427 .0445 -.0018 .0093 -.0022 |
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H7B .1276 .0909 .2021 .0494 .0338 .0515 .0009 .0060 -.0066 |
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H8A .9160 .1958 .1158 .0488 .0436 .0332 -.0002 .0109 -.0061 |
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H8B .8064 .1290 .0364 .0335 .0829 .0072 -.0101 .0121 -.0210 |
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H9A .4004 .1177 .3362 .0611 .0370 .0760 .0035 .0185 .0143 |
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H9B .6152 .2359 .0967 .0587 .0603 .0389 .0065 .0122 -.0049 |
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