American Mineralogist Crystal Structure Database

17 matching records for this search.

KAlF4
 
Launay J, Bulou A, Hewat A, Gibaud A, Laval J, Nouet J
 
Journal de Physique 46 (1985) 771-782
Shear transformation in the layered compound KAlF4: low temperature
phase structure and transformation mechanism
_cod_database_code 1000207
_database_code_amcsd 0012760
5.0449 5.0449 6.1592 90 90 90 P4/mbm
atom     x     y     z
Al1      0     0     0
K1      .5     0    .5
F1   .2826 .2174     0
F2       0     0 .2828
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KAlF4
 
Launay J, Bulou A, Hewat A, Gibaud A, Laval J, Nouet J
 
Journal de Physique 46 (1985) 771-782
Shear transformation in the layered compound KAlF4: low temperature
phase structure and transformation mechanism
_cod_database_code 1000208
_database_code_amcsd 0012761
7.3403 7.2370 6.4070 90 106.801 90 P2_1/m
atom     x      y     z
Al1      0      0     0
Al2     .5      0     0
K1    .131    .25  .541
K2    .633    .25  .544
F1   .2581 -.0205 .0077
F2    .029    .25  .051
F3   .4874    .25  .044
F4   .0712 -.0370 .2836
F5   .5738 -.0361 .2840
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Al F4 Rb
 
Bulou A, Nouet J
 
Journal of Physics C: Solid State Physics 15 (1982) 183-196
Structural phase transitions in ferroelastic Rb al F4: I. DSC, x-ray
powder diffraction investigations and neutron powder profile refinement
of the structures
_cod_database_code 1000453
_database_code_amcsd 0013168
3.6586 3.6586 6.3061 90 90 90 P4/mmm
atom  x  y     z
Rb1  .5 .5    .5
Al1   0  0     0
F1   .5  0     0
F2    0  0 .2770
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Al F4 Rb
 
Bulou A, Nouet J
 
Journal of Physics C: Solid State Physics 15 (1982) 183-196
Structural phase transitions in ferroelastic Rb al F4: I. DSC, x-ray
powder diffraction investigations and neutron powder profile refinement
of the structures
_cod_database_code 1000454
_database_code_amcsd 0013169
5.1375 5.1375 6.2912 90 90 90 P4/mbm
atom     x     y     z
Rb1      0    .5    .5
Al1      0     0     0
F1   .2801 .2199     0
F2       0     0 .2771
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Al F4 Rb
 
Bulou A, Nouet J
 
Journal of Physics C: Solid State Physics 15 (1982) 183-196
Structural phase transitions in ferroelastic Rb al F4: I. DSC, x-ray
powder diffraction investigations and neutron powder profile refinement
of the structures
_cod_database_code 1000455
_database_code_amcsd 0013170
5.1227 5.1227 6.2815 90 90 90 P4/mbm
atom     x     y     z
Rb1      0    .5    .5
Al1      0     0     0
F1   .2841 .2159     0
F2       0     0 .2776
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RbAlF4
 
Bulou A, Nouet J
 
Journal of Physics C: Solid State Physics 15 (1982) 183-196
Structural phase transitions in ferroelastic RbAlF4: I. DSC, X-ray powder diffraction
investigations and neutron powder profile refinement of the structures
_cod_database_code 1000456
_database_code_amcsd 0013171
7.2285 7.2252 6.2624 90 90 90 *Pmmn
.25 .25 0
atom     x      y     z
Rb1    .25    .25  .480
Rb2    .25    .75  .518
Al1      0      0     0
F1     .25 -.0304     0
F2    .040    .25 .0330
F3   -.001 -.0186 .2786
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Al F4 Rb
 
Bulou A, Nouet J
 
Journal of Physics C: Solid State Physics 15 (1982) 183-196
Structural phase transitions in ferroelastic RbAlF4: I. DSC, X-ray powder diffraction
investigations and neutron powder profile refinement of the structures
_cod_database_code 1000457
_database_code_amcsd 0013172
7.2124 7.2073 6.2396 90 90 90 *Pmmn
.25 .25 0
atom      x      y     z
Rb1     .25    .25  .487
Rb2     .25    .75  .533
Al1       0      0     0
F1      .25 -.0356 -.021
F2    .0396    .25 .0350
F3   -.0098 -.0232 .2786
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KAlF4
 
Gibaud A, Le Bail A, Bulou A
 
Journal of Physics C: Solid State Physics 19 (1986) 4623-4633
A re-investigation of the room-temperature phase of KAlF4: evidence
of antiphase domains
_cod_database_code 1000125
_database_code_amcsd 0013176
5.0424 5.0424 6.1564 90 90 90 P4/mbm
atom     x     y     z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
K        0    .5    .5  .0127  .0127  .0243  .0077      0      0
Al       0     0     0  .0035  .0035  .0113      0      0      0
F1       0     0 .2830  .0238  .0238  .0135      0      0      0
F2   .2984 .7984     0  .0049  .0049  .0320 -.0028      0      0
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KAlF4
 
Gibaud A, Le Bail A, Bulou A
 
Journal of Physics C: Solid State Physics 19 (1986) 4623-4633
A re-investigation of the room-temperature phase of KAlF4: evidence
of antiphase domains
_cod_database_code 1000126
_database_code_amcsd 0013177
5.0431 5.0431 6.1567 90 90 90 P4/mbm
atom     x     y     z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
K        0    .5    .5  .0157  .0157  .0211  .0001      0      0
Al       0     0     0  .0061  .0061  .0033      0      0      0
F1       0     0 .2843  .0324  .0324 -.0006      0      0      0
F2   .2986 .7986     0  .0058  .0058  .0333 -.0044      0      0
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KAlF4
 
Gibaud A, Le Bail A, Bulou A
 
Journal of Physics C: Solid State Physics 19 (1986) 4623-4633
A re-investigation of the room-temperature phase of KAlF4: evidence
of antiphase domains
_cod_database_code 1000127
_database_code_amcsd 0013178
5.0432 5.0432 6.1573 90 90 90 P4/mbm
atom    x    y     z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
K       0   .5    .5  .0160  .0160  .0199  .0024      0      0
Al      0    0     0  .0054  .0054  .0044      0      0      0
F1      0    0 .2859  .0345  .0345 -.0019      0      0      0
F2   .294 .794     0  .0128  .0128  .0352 -.0105      0      0
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Oskarssonite
 
Daniel P, Bulou A, Rousseau M, Nouet J, Fourquet J, Leblanc M, Burriel R
 
Journal of Physics: Condensed Matter 2 (1990) 5663-5677
A study of the structural phase transitions in AlF3: X-ray powder
diffraction, DSC and Raman scattering investigations of the lattice
dynamics and phonon spectrum
_cod_database_code 1000467
_database_code_amcsd 0013259
4.9305 4.9305 12.4462 90 90 120 R-3c
atom     x y   z
Al       0 0   0
F    .4275 0 .25
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F4 Fe Rb
 
Moron M, Bulou A, Pique C, Fourquet J
 
Journal of Physics: Condensed Matter 2 (1990) 8269-8275
Structural phase transitions in Rb Fe F4: I.Powder and single crystal
X-ray diffraction study of the room temperature phase
_cod_database_code 1000439
_database_code_amcsd 0013260
7.6651 7.6316 6.2789 90 90 90 Pmab
atom     x      y      z
Fe1      0      0      0
Rb1    .25  .2824  .5136
F1       0    .25 -.0711
F2     .25 -.0093 -.0630
F3   .0410  .0497  .2889
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NH4AlF4
 
Bulou A, Leble A, Hewat A
 
Materials Research Bulletin 17 (1982) 391-397
NH4AlF4: Determination of the Ordered and Disordered Structures by
Neutron Powder Profile Refinement
_cod_database_code 1000182
_database_code_amcsd 0014295
5.0875 5.0875 12.7319 90 90 90 I4/mcm
atom      x     y     z occ
N1        0    .5   .25
H1   -.0015 .3303 .2043  .5
Al1       0     0     0
F1        0     0 .1386
F2    .2102 .7102     0
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NH4AlF4
 
Bulou A, Leble A, Hewat A
 
Materials Research Bulletin 17 (1982) 391-397
NH4AlF4: Determination of the Ordered and Disordered Structures by
Neutron Powder Profile Refinement
_cod_database_code 1000183
_database_code_amcsd 0014296
5.0564 5.0564 12.7113 90 90 90 P4_2/mbc
atom     x     y     z
N1       0     0   .25
H1   .0017 .8310 .2030
Al1      0    .5     0
F1       0    .5 .1394
F2   .2957 .2980     0
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F3 V
 
Daniel P, Bulou A, Leblanc M, Rousseau M, Nouet J
 
Materials Research Bulletin 25 (1990) 413-420
Structural and vibrational study of V F3
_cod_database_code 1000468
_database_code_amcsd 0014345
5.168 5.168 13.438 90 90 120 R-3c
atom     x y   z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
V1       0 0   0  .0051  .0051  .0060 .00255      0      0
F1   .4001 0 .25  .0122  .0106  .0132  .0053 -.0027 -.0054
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Al F4 H4 N
 
Fourquet J, Plet F, Courbion G, Bulou A, de Pape R
 
Revue de Chimie Minerale 16 (1979) 490-500
Etude de la filiation structurale des phases M(I)AlF4
(M(I) = K, Rb, Tl, N H4, Cs)
_cod_database_code 1000199
_database_code_amcsd 0015388
5.078 5.078 12.715 90 90 90 I-4c2
atom     x     y     z
N1       0    .5   .25
Al1      0     0     0
F1       0     0 .1386
F2   .2097 .7097     0
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RbAlF4
 
Fourquet J, Plet F, Courbion G, Bulou A, de Pape R
 
Revue de Chimie Minerale 16 (1979) 490-500
Etude de la filiation structurale des phases M(I)AlF4 (M(I) = K,Rb,Tl,NH4,Cs)
_cod_database_code 1000496
_database_code_amcsd 0015389
5.125 5.125 6.283 90 90 90 P4/mbm
atom    x    y    z
Rb1     0   .5   .5
Al1     0    0    0
F1   .237 .737    0
F2      0    0 .273
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Total number of retrieved datasets: 17
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