American Mineralogist Crystal Structure Database

5 matching records for this search.

Ba6 Ni25 S27
 
Gelabert M, Ho M, Malik A, DiSalvo F, Deniard P, Brec R
 
Chemistry - A European Journal 3 (1997) 1884-1889
Structure and properties of Ba6 Ni25 S27
_cod_database_code 1005034
_database_code_amcsd 0012194
10.0565 10.0565 10.0565 90 90 90 Pm3m
atom     x     y     z
Ba1     .5    .5 .1945
Ni1      0     0     0
Ni2  .1360 .3562 .1360
S1      .5    .5    .5
S2       0 .2377     0
S3   .2822 .2822 .2822
S4       0    .5 .2416
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Ba Co S2
 
Gelabert M, Brese N, DiSalvo F, Jobic S, Deniard P, Brec R
 
Journal of Solid State Chemistry 127 (1996) 211-221
Polymorphism and superstructure in Ba Co S2-d
_cod_database_code 1005029
_database_code_amcsd 0013910
4.568 4.568 8.942 90 90 90 *P4/nmm
.25 -.25 0
atom   x   y     z
Ba1  .25 .25 .6975
Co1  .25 .25 .0933
S1   .25 .25 .3488
S2   .75 .25     0
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Ba Co S1.84
 
Gelabert M, Brese N, DiSalvo F, Jobic S, Deniard P, Brec R
 
Journal of Solid State Chemistry 127 (1996) 211-221
Polymorphism and superstructure in Ba Co S2-d
_cod_database_code 1005030
_database_code_amcsd 0013911
6.4390 6.4909 8.9379 90 90 90 Cmma
atom   x   y     z occ
Ba1    0 .25 .1973
Co1    0 .25 .5895
S1     0 .25 .8433
S2   .25  .5    .5 .84
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F5 Fe H8 N2
 
Croguennec L, Deniard P, Brec R, Couzi M, Sourisseau C, Fourquet J, Calage Y
 
Journal of Solid State Chemistry 131 (1997) 189-197
Structural and spectroscopic evidence for hydrogen bonding induced (N
H4)(+) cation ordering in beta-(N H4)2 Fe F5 at low temperature
_cod_database_code 1000445
_database_code_amcsd 0013924
6.3385 7.6191 11.0298 90 90 90 Pnma
atom     x     y     z
N1    .428   .25 .1958
N2    .510   .25 .8584
Fe1      0     0     0
F1   .0880   .25 .0082
F2   .2271 .0521 .4367
F3   .1051 .5265 .1595
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F5 Fe H8 N2
 
Croguennec L, Deniard P, Brec R, Couzi M, Sourisseau C, Fourquet J, Calage Y
 
Journal of Solid State Chemistry 131 (1997) 189-197
Structural and spectroscopic evidence for hydrogen bonding induced (N
H4)(+) cation ordering in beta-(N H4)2 Fe F5 at low temperature
_cod_database_code 1000446
_database_code_amcsd 0013925
6.3269 7.6076 10.9802 90 90 90 Pnma
atom    x     y     z
N1   .442   .25  .198
N2   .512   .25  .854
Fe1     0     0     0
F1   .081   .25 -.002
F2   .225  .045  .442
F3   .102  .546  .163
H1   .426 .3573  .872
H2    .64   .25   .90
H3    .55   .25  .766
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Total number of retrieved datasets: 5
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