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Heulandite-K |
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Yang P, Armbruster T |
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Journal of Solid State Chemistry 123 (1996) 140-149 |
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Na, K, Rb and Cs exchange in heulandite single-crystals: X-ray structure |
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refinements at 100 K |
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Sample: T = 100 K |
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Locality: Nasik, India |
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_database_code_amcsd 0013885 |
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17.636 17.9340 7.397 90 116.00 90 C2/m |
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atom x y z occ Biso |
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K1 .0101 -.0967 .413 .26 12.3 |
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K3 .7552 .5 -.0582 .90 2.29 |
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K3' .290 0 .048 .06 3.8 |
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K4 .0290 .5 .1708 .44 3.47 |
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K4' .013 .5 .425 .10 3.95 |
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K4" .5 0 .5 .16 3.95 |
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Al1 .17999 .16907 .1019 .23 1.01 |
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Si1 .17999 .16907 .1019 .77 1.01 |
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Al2 .28612 .08907 .4982 .42 1.12 |
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Si2 .28612 .08907 .4982 .58 1.12 |
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Al3 .29382 .30981 .2857 .2 1.03 |
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Si3 .29382 .30981 .2857 .8 1.03 |
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Al4 .06515 .29789 .4134 .15 1.04 |
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Si4 .06515 .29789 .4134 .85 1.04 |
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Al5 0 .21625 0 .15 1.16 |
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Si5 0 .21625 0 .85 1.16 |
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O1 .3052 0 .5475 2.60 |
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O2 .2302 .1192 .6140 2.24 |
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O3 .1858 .1555 .8916 2.15 |
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O4 .2321 .1018 .2510 1.99 |
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O5 0 .3272 .5 2.69 |
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O6 .0814 .1624 .0624 1.76 |
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O7 .3789 .2709 .4521 2.56 |
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O8 .0086 .2695 .1843 2.30 |
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O9 .2160 .2504 .1968 1.91 |
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O10 .1211 .3687 .4101 2.04 |
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Wat1 .089 0 .018 .18 4.2 |
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Wat2 .3991 -.0930 .0461 6.29 |
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Wat3 -.0811 0 .216 .73 6.5 |
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Wat4 0 0 0 .16 1.70 |
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Wat5 .0753 0 .183 .98 4.1 |
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Wat6 .513 0 .318 .12 .9 |
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Wat7 .021 0 .07 .14 1.60 |
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Wat8 .104 0 .480 .18 9.70 |
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Wat9 0 .459 .02 .12 9.67 |
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Wat10 .862 0 .316 .17 .9 |
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