American Mineralogist Crystal Structure Database

2 matching records for this search.

Phosphophyllite
Download hom/phosphophyllite.pdf
Hill R J
Download am/vol62/AM62_812.pdf
American Mineralogist 62 (1977) 812-817
The crystal structure of phosphophyllite
_database_code_amcsd 0000588
10.378 5.084 10.553 90 121.14 90 P2_1/c
atom      x      y      z Biso B(1,1) B(2,2) B(3,3)  B(1,2) B(1,3)  B(2,3)
Fe        0      0      0      .00286 .00689 .00250  .00051 .00139  .00047
Zn   .50024 .31002 .35646      .00321 .00559 .00249 -.00031 .00174 -.00004
P    .68924 .28707 .19476      .00183 .00478 .00218  .00007 .00111 -.00028
O1   -.0046  .2958  .1392       .0075  .0130  .0059  -.0035  .0049  -.0035
O2    .1803  .2897  .5030       .0051  .0145  .0078  -.0003  .0045  -.0008
O3    .8542  .2582  .3158       .0022  .0085  .0033   .0004  .0005  -.0011
O4    .3526  .0728  .3420       .0041  .0067  .0062  -.0017  .0032  -.0016
O5    .6617  .1323  .0582       .0035  .0112  .0021   .0017  .0012  -.0007
O6    .5860  .1527  .2445       .0044  .0079  .0043  -.0019  .0034  -.0017
H1    -.030  .2760   .195  2.0
H2     .054   .403   .177  4.4
H3     .231   .358   .491    8
H4     .219   .154   .547   10
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Phosphophyllite
Download hom/phosphophyllite.pdf
Kleber W, Liebau F, Piatkowiak E
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0365-110X&volume=14&spage=795
Acta Crystallographica 14 (1961) 795-795
Zur struktur des phosphophyllits, Zn2Fe[PO4]2*4H2O
_database_code_amcsd 0009263
10.23 5.08 10.49 90 120.25 90 P2_1/c
atom    x   y    z
Fe      0   0    0
Zn   .500 .78 .148
P    .317 .21 .000
O1   .159 .34 .467
O2   .344 .50 .019
O3   .333 .46 .390
O4   .415 .11 .155
Wat1 .002 .33 .129
Wat2 .183 .17 .188
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
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Total number of retrieved datasets: 2
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