American Mineralogist Crystal Structure Database

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Gismondine
Download hom/gismondine.pdf
Wadoski-Romeijn E, Armbruster T
American Mineralogist 98 (2013) 1988-1997
Topotactic transformation and dehydration of the zeolite gismondine
to a novel Ca feldspar structure
Note: T = 75 C, Path 2
Locality: Rio Pian del Foco, Genova province, Italy
_database_code_amcsd 0020102
9.790 10.437 9.790 90 90.97 90 I2/a
atom      x      y      z  occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Si   .06981 .35773 .34690      .0134  .0126  .0119  .0156 .00100  .0008 -.0010
Al   .10332 .11131 .16930      .0140  .0150  .0128  .0143 -.0023  .0018 -.0022
Ca1   .3047 -.0854  .3313 .254 .0362   .052   .024   .033  .0073  .0133  .0027
Ca2  -.0947  .1612  .5544 .186 .0361   .032   .029   .046 -.0016 -.0094  .0034
O1   -.0369  .4629  .2857      .0277  .0367  .0223  .0238  .0141 -.0055 -.0005
O2    .0528  .3419  .5079      .0302  .0433  .0313  .0161 -.0021  .0011 -.0018
O3    .0310  .2210  .2800      .0267  .0265  .0188  .0348 -.0001  .0035 -.0132
O4    .2784  .0968  .1954      .0307  .0142  .0317   .046 -.0027  .0072  .0024
Wat1  .2261 -.2820  .4124 .395  .076   .053   .098   .079  -.022   .013  -.016
Wat2 -.0298  .0590  .5103  .60  .129   .075    .24   .069   .012   .001   .044
Wat3 -.1621 -.0303  .4980  .41  .099   .106   .138   .054   .046  -.005  -.016
Wat4   .276  -.149   .296  .51   .17   .062    .29    .14    .08  -.003    .07
Wat5   .245  -.239   .309  .13  .032
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