American Mineralogist Crystal Structure Database

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Delhayelite
Download hom/delhayelite.pdf
Cannillo E, Rossi G, Ungaretti L
 
Rendiconti della Societa Italiana di Mineralogia e Petrologia 26 (1970) 63-75
The crystal structure of delhayelite
_database_code_amcsd 0015364
24.86 7.07 6.53 90 90 90 *Pmmn
-.25 -.25 0
atom     x     y     z occ Biso
K1   .1322   .25 .7804 .88 1.95
K2     .25   .25 .3721  .9 2.76
K3     .25   .75 .0195 .85 4.45
Na       0     0     0 .75 1.07
CaNa     0     0     0 .25 1.07
Ca   .0067   .75 .5034      .81
Al1  .1828   .75 .5342  .5  .59
Si1  .1125 .4656 .2818      .51
Si2  .1828   .75 .5342  .5  .59
Si3  .1065   .75 .9188      .70
O1   .0550 .4818 .3845     3.76
O2   .1618 .5510 .4135     4.01
O3   .1124 .5675 .0601     3.28
O4   .0491   .75 .8164     1.64
O5   .1580   .75 .7738     2.73
O6   .1295   .25 .2433     2.96
O7     .25   .75 .5392     2.32
Cl     .25   .25 .8793  .9 3.83
F    .0297   .25 .8146     2.02
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