American Mineralogist Crystal Structure Database

8 matching records for this search.

H10 Hf K4 O21
 
Tranqui D, Boyer P, Laugier J, Vulliet P
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-7681&volume=33&spage=3126
Acta Crystallographica B33 (1977) 3126-3133
Structure cristalline du tetrakisoxalatohafniate de potassium
pentahydrate  K4 Hf (C2 O4)4 (H2 O)5
_cod_database_code 1008018
_database_code_amcsd 0015966
10.640 12.350 15.940 90 94.27 90 P2_1/c
atom      x      y       z
Hf1  .76273 .34876  .17271
K1   .12726 .34486  .24721
K2   .01702 .22821  .51150
K3   .50892 .06103  .30899
K4   .39160 .32650  .40996
O1   .63788 .38921  .27242
O2   .87488 .35036  .29234
O3   .88647 .39037  .42764
O4   .62873 .43314  .40704
O5   .56678 .36980  .11623
O6   .76234 .31897  .03836
O7   .65421 .31489 -.08427
O8   .44291  .3774 -.00339
O9   .93910 .42186  .13714
O10  .74013 .52285  .16299
O11  .82155 .68276  .13010
O12  .03915 .56884  .09761
O13  .90743 .22115  .16452
O14  .67786  .1920  .19308
O15  .70332 .01329  .20501
O16  .95776 .04939  .18800
C1   .68637 .40347  .34949
C2   .82980 .37886  .36056
C3   .54439 .36146  .03653
C4   .65975 .32883 -.01118
C5   .94762 .52157  .12290
C6   .82844 .58467  .14013
C7   .88430 .12425  .18171
C8   .74065 .10400  .19579
O17  .17197 .42795  .46924
O18  .18617 .15217  .14905
O19  .22442 .40628  .08490
O20  .39409 .25709  .24569
O21  .45955 .13587  .07610
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D3.054 Mn2 Zr
 
Pontonnier L, Miraglia S, Fruchart D, Soubeyroux J, Baudry A, Boyer P
 
Journal of Alloys and Compounds 186 (1992) 241-248
Structural study of hyperstoichiometric alloys ZrMn2+x and their hydrides
_cod_database_code 1008563
_database_code_amcsd 0016454
5.4055 5.4055 8.7964 90 90 120 P6_3/mmc
atom     x     y     z  occ
Zr1    1/3   2/3 .0629
Mn1      0     0     0
Mn2  .8366 .6732   .25
D1   .0398 .3249 .5647 .211
D2   .4594 .9188 .6261 .372
D3    .466  .932   .25 .369
D4   .2021 .4042   .25 .079
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D2.332 Mn2.15 Zr0.85
 
Pontonnier L, Miraglia S, Fruchart D, Soubeyroux J, Baudry A, Boyer P
 
Journal of Alloys and Compounds 186 (1992) 241-248
Structural study of hyperstoichiometric alloys ZrMn2+x and their hydrides
_cod_database_code 1008564
_database_code_amcsd 0016455
5.3889 5.3889 8.7660 90 90 120 P6_3/mmc
atom     x     y     z  occ
Zr1    1/3   2/3 .0637  .85
Mn1    1/3   2/3 .0637  .15
Mn2      0     0     0
Mn3  .8369 .6738   .25
D1   .0506 .3477 .5662 .164
D2   .4524 .9048 .6352 .278
D3   .4540 .9080   .25 .298
D4     .22   .44   .25 .045
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D2.83 Mn2 Zr
 
Pontonnier L, Miraglia S, Fruchart D, Soubeyroux J, Baudry A, Boyer P
 
Journal of Alloys and Compounds 186 (1992) 241-248
Structural study of hyperstoichiometric alloys ZrMn2+x and their hydrides
_cod_database_code 1008565
_database_code_amcsd 0016456
5.3889 5.3889 8.7660 90 90 120 P6_3/mmc
atom     x     y     z  occ
Zr1    1/3   2/3 .0642
Mn1      0     0     0
Mn2   .839  .678   .25
D1   .0433 .3255 .5169 .191
D2   .4633 .9266 .6263 .353
D3   .4676 .9352   .25 .356
D4     .22   .44   .25 .061
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D2.113 Mn2.227 Zr0.772
 
Pontonnier L, Miraglia S, Fruchart D, Soubeyroux J, Baudry A, Boyer P
 
Journal of Alloys and Compounds 186 (1992) 241-248
Structural study of hyperstoichiometric alloys ZrMn2+x and their hydrides
_cod_database_code 1008566
_database_code_amcsd 0016457
5.3493 5.3493 8.6995 90 90 120 P6_3/mmc
atom     x     y     z  occ
Zr1    1/3   2/3 .0632 .772
Mn1    1/3   2/3 .0632 .227
Mn2      0     0     0
Mn3  .8302 .6604   .25
D1   .0397 .3219 .5706 .146
D2   .4478 .8956 .6254 .247
D3   .4800 .9600   .25 .286
D4    .262  .524   .25 .045
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D2.23 Ni Zr2
 
Chikdene A, Baudry A, Boyer P, Miraglia S, Fruchart D, Soubeyroux J
 
Zeitschrift fur Physikalische Chemie 163 (1989) 219-224
Neutron diffraction studies of Zr2NiH(D)x hydrides
_cod_database_code 1008445
_database_code_amcsd 0016350
6.6573 6.6573 5.3862 90 90 90 I4/mcm
atom     x     y      z  occ
Ni1      0     0    .25
Zr1  .1675 .6675      0
D1       0    .5   -.24 .006
D2   .3750 .8750 -.1163 .520
D3    .218  .924  -.193 .017
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D3.78 Ni Zr2
 
Chikdene A, Baudry A, Boyer P, Miraglia S, Fruchart D, Soubeyroux J
 
Zeitschrift fur Physikalische Chemie 163 (1989) 219-224
Neutron diffraction studies of Zr2NiH(D)x hydrides
_cod_database_code 1008446
_database_code_amcsd 0016351
6.7357 6.7357 5.4752 90 90 90 I4/mcm
atom     x     y      z  occ
Ni1      0     0    .25
Zr1  .1653 .6653      0
D1       0    .5  -.251 .056
D2   .3735 .8735 -.1148 .496
D3    .218  .924  -.193  .21
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D7.16 Ni Zr2
 
Chikdene A, Baudry A, Boyer P, Miraglia S, Fruchart D, Soubeyroux J
 
Zeitschrift fur Physikalische Chemie 163 (1989) 219-224
Neutron diffraction studies of Zr2NiH(D)x hydrides
_cod_database_code 1008447
_database_code_amcsd 0016352
6.8280 6.8280 5.6862 90 90 90 I4/mcm
atom     x     y      z  occ
Ni1      0     0    .25
Zr1  .1639 .6639      0
D1       0    .5  -.236 .099
D2   .3717 .8717 -.1252 .384
D3   .2130 .9170 -.1873 .655
D4    .102  .001      0 .047
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Total number of retrieved datasets: 8
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