American Mineralogist Crystal Structure Database

2 matching records for this search.

Montesommaite
Download hom/montesommaite.pdf
Rouse R C, Dunn P J, Grice J D, Schlenker J L, Higgins J B
Download am/vol75/AM75_1415.pdf
American Mineralogist 75 (1990) 1415-1420
Montesommaite, (K,Na)9Al9Si23O64.10H2O, a new zeolite related to merlinoite and
the gismondine group
_database_code_amcsd 0001338
7.141 7.141 17.307 90 90 90 *I4_1/amd
0 -.25 .125
atom     x    y    z occ Uiso
K        0    0   .5     .025
Al       0 .463 .090 .29 .005
Si       0 .463 .090 .71 .005
O1       0  .25 .116     .015
O2   .1857 .436  7/8     .015
O3       0    0    0     .015
Wat      0  .25 .342 .25 .015
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Brewsterite-Sr
Download hom/brewsteritesr.pdf
Schlenker J L, Pluth J J, Smith J V
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-7681&volume=33&spage=2907
Acta Crystallographica B33 (1977) 2907-2910
Refinement of the crystal structure of brewsterite, Ba0.5Sr1.5Al4Si12O32*10H2O
_database_code_amcsd 0009605
6.793 17.573 7.759 90 94.54 90 P2_1/m
atom      x     y     z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
Sr    .2501   .25 .1780 .71  .0080  .0009  .0042      0  .0005      0
Ba    .2501   .25 .1780 .24  .0080  .0009  .0042      0  .0005      0
K     .2501   .25 .1780 .01  .0080  .0009  .0042      0  .0005      0
Al(A) .3218 .0812 .8224 .27  .0054  .0013  .0029  .0001  .0002      0
Si(A) .3218 .0812 .8224 .73  .0054  .0013  .0029  .0001  .0002      0
Al(B) .4054 .0566 .2108 .37  .0068  .0012  .0036  .0001  .0005  .0001
Si(B) .4054 .0566 .2108 .63  .0068  .0012  .0036  .0001  .0005  .0001
Al(C) .5553 .1582 .5336 .36  .0064  .0011  .0031  .0002  .0007  .0002
Si(C) .5553 .1582 .5336 .64  .0064  .0011  .0031  .0002  .0007  .0002
Si(D) .9087 .0528 .6410      .0050  .0010  .0036  .0002      0 -.0001
O1    .3501 .1059 .0283      .0122  .0018  .0037 -.0003  .0009 -.0002
O2    .4218 .1240 .3607      .0104  .0029  .0062  .0008  .0009 -.0013
O3    .7825 .1211 .5454      .0096  .0019  .0071  .0013  .0012  .0009
O4    .4500 .1408 .7150      .0117  .0021  .0054  .0001  .0029  .0006
O5    .0850 .0920 .7615      .0081  .0025  .0097  .0022 -.0022 -.0020
O6    .2228 .9966 .2388      .0139  .0022  .0128 -.0012  .0022  .0021
O7    .3851 .9921 .7952      .0094  .0016  .0074  .0006  .0005 -.0004
O8        0     0    .5      .0189  .0030  .0096  .0029 -.0015 -.0030
O9    .5718   .25 .4994      .0204  .0014  .0134      0  .0089      0
Wat1  .0598   .25 .4699      .0256  .0040  .0123      0  .0063      0
Wat2  .9286 .1474 .1518      .0234  .0045  .0299  .0007  .0079  .0035
Wat3  .5996   .25 .0241      .0185  .0037  .0224      0  .0067      0
Wat4  .0665   .25 .8660      .0395  .0022  .0112      0 -.0017      0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Download in:

Multiple datasets can be concatenated into a single downloadable file by selecting the datasets and then hitting the "Download Selected Data" button.

Total number of retrieved datasets: 2
View in amc, download in amc


Return to AMCSD Home Page