American Mineralogist Crystal Structure Database

5 matching records for this search.

Archerite
Download hom/archerite.pdf
Frazer B C, Pepinsky R
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0365-110X&volume=6&spage=273
Acta Crystallographica 6 (1953) 273-285
X-ray analysis of the ferroelectric transition in KH2PO4
Sample: at T = 126 K
Locality: synthetic
Note: low-temperature polymorph of archerite
_database_code_amcsd 0009154
10.48 10.48 6.90 90 90 90 F-4d2
atom    x    y    z occ Biso
K       0    0   .5      .47
P       0    0    0      .40
O    .118 .033 .132  .5  .48
OH   .118 .033 .132  .5  .48
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Archerite
Download hom/archerite.pdf
Frazer B C, Pepinsky R
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0365-110X&volume=6&spage=273
Acta Crystallographica 6 (1953) 273-285
X-ray analysis of the ferroelectric transition in KH2PO4
Sample: at T = 116 K
Locality: synthetic, low-temperature form
_database_code_amcsd 0009155
10.53 10.44 6.90 90 90 90 Fdd
atom     x    y     z occ Biso
K        0    0  .512      .46
P        0    0     0      .39
O1    .116 .035  .136  .5  .37
OH1   .116 .035  .136  .5  .37
O2   -.035 .116 -.124  .5  .37
OH2  -.035 .116 -.124  .5  .37
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H3 Li O2
 
Pepinsky R
 
Zeitschrift fur Kristallographie 102 (1940) 119-140
Crystal Structure of Lithium Hydroxide Monohydrate
_cod_database_code 1010456
_database_code_amcsd 0017376
7.37 8.26 3.19 90 110.3 90 C2/m
atom    x    y    z
Li1     0  .35   .5
O1      0 .211    0
O2   .286    0 .389
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Barioperovskite
 
Shirane G, Danner H, Pepinsky R
 
Physical Review 105 (1957) 856-860
Neutron diffraction study of orthorhombic BaTiO3
Locality: synthetic
Note: orthorhombic structure
_database_code_amcsd 0018581
3.990 5.669 5.682 90 90 90 Amm2
atom  x    y     z
Ba    0    0     0
Ti   .5    0  .510
O1    0    0  .490
O2   .5 .253  .237
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BaTiO3
 
Shirane G, Danner H, Pepinsky R
 
Physical Review 105 (1957) 856-860
Neutron diffraction study of orthorhombic BaTiO3
Locality: synthetic
Note: tetragonal structure
_database_code_amcsd 0018582
3.986 3.986 4.026 90 90 90 P4mm
atom  x  y     z
Ba    0  0     0
Ti   .5 .5  .265
OI   .5 .5 -.023
OII1 .5  0  .236
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Download CIF data (View Text File)
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View JMOL 3-D Structure
 
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Total number of retrieved datasets: 5
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