American Mineralogist Crystal Structure Database

1 matching records for this search.

Na.5H.5AlSi206
 
Muller G, Paulus H, Stiefel J
Neues Jahrbuch fur Mineralogie, Monatshefte 1990 (1990) 493-503
Synthesis and structure of beta-quartz type
Na0.5H0.5AlSi206 as compared to LiAlSi206
Note: stuffed beta-quartz type structure
Sample: ref 2
_database_code_amcsd 0014848
5.150 5.150 5.458 90 90 120 P6_222
atom     x     y  z  occ Biso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Na       0     0  0 .167  6.6   .082   .026   .143   .013      0      0
H        0     0  0 .167  6.6   .082   .026   .143   .013      0      0
Al      .5     0  0  1/3  3.5   .060   .027   .049   .013      0      0
Si      .5     0  0  2/3  3.5   .060   .027   .049   .013      0      0
O    .2080 .4160 .5       5.3   .063   .123   .117   .061   .019      0
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