|
O3 Ta0.18 W0.82 Y0.06 |
| |
Studer F, Montfort Y, Raveau B |
| |
Journal of Solid State Chemistry 7 (1973) 269-276 |
|
Evolution structurale de nouvelles Perovskites lacunaires Yx(Ta3xW1-3x)O3 |
|
_cod_database_code 1001123 |
|
_database_code_amcsd 0013314 |
|
5.298 5.377 3.774 90 90 90 Cmmm |
|
atom x y z occ |
|
Ta1 .5 0 .5 .18 |
|
W1 .5 0 .5 .82 |
|
Y1 0 0 0 .06 |
|
O1 .5 0 0 |
|
O2 .25 .25 .5 |
|
|
| Download AMC data (View Text File)
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|
| |
|
O3 Ta0.72 W0.28 Y0.24 |
| |
Studer F, Montfort Y, Raveau B |
| |
Journal of Solid State Chemistry 7 (1973) 269-276 |
|
Evolution structurale de nouvelles Perovskites lacunaires Yx(Ta3xW1-3x)O3 |
|
_cod_database_code 1001124 |
|
_database_code_amcsd 0013315 |
|
3.833 3.833 3.833 90 90 90 Pm3m |
|
atom x y z occ |
|
Ta1 .5 .5 .5 .72 |
|
W1 .5 .5 .5 .28 |
|
Y1 0 0 0 .24 |
|
O1 0 .5 .5 |
|
|
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|
| |
|
O3 Ta0.9 W0.1 Y0.3 |
| |
Studer F, Montfort Y, Raveau B |
| |
Journal of Solid State Chemistry 7 (1973) 269-276 |
|
Evolution structurale de nouvelles Perovskites lacunaires Yx(Ta3xW1-3x)O3 |
|
_cod_database_code 1001125 |
|
_database_code_amcsd 0013316 |
|
3.833 3.833 7.727 90 90 90 P4/mmm |
|
atom x y z occ |
|
Ta1 .5 .5 .238 .9 |
|
W1 .5 .5 -.238 .1 |
|
Y1 0 0 .5 .6 |
|
O1 .5 .5 0 |
|
O2 .5 .5 .5 |
|
O3 0 .5 .262 |
|
|
| Download AMC data (View Text File)
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|
| |
|
Cu3 O21 Rb Ta7 |
| |
Benmoussa A, Groult D, Studer F, Raveau B |
| |
Journal of Solid State Chemistry 41 (1982) 221-226 |
|
Intergrowth of Hexagonal Tungsten Bronze and Perovskite-like |
|
Structures: The Oxides A Cu3 M7 O21 (A = K, Rb, Cs, Tl; M = Nb, Ta) |
|
_cod_database_code 1001218 |
|
_database_code_amcsd 0013465 |
|
28.11 7.503 7.548 90 90 90 Cmmm |
|
atom x y z occ |
|
Rb1 0 0 0 |
|
Rb2 0 0 .5 |
|
Cu1 .173 0 .5 |
|
Cu2 .321 0 .5 .5 |
|
Cu3 .318 0 0 |
|
Cu4 .183 0 0 .5 |
|
Ta1 0 .5 .244 |
|
Ta2 .1131 .2477 .255 |
|
Ta3 .25 .25 .252 |
|
O1 .088 0 .248 |
|
O2 .274 0 .220 |
|
O3 .366 0 .202 |
|
O4 .179 .164 .280 |
|
O5 .046 .304 .280 |
|
O6 .124 .322 .5 |
|
O7 .128 .187 0 |
|
O8 .236 .323 .5 .5 |
|
O9 .238 .186 0 .5 |
|
O10 .5 0 .5 |
|
O11 .5 0 0 |
|
|
| Download AMC data (View Text File)
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|
| |
|
Ba La O6 Ru Zn |
| |
Battle P, Gibb T, Jones C, Studer F |
| |
Journal of Solid State Chemistry 78 (1989) 281-293 |
|
Spin-Glass Behavior in Sr2 Fe Ru O6 and Ba La Ni Ru O6: A |
|
Comparison with Antiferromagnetic Ba La Zn Ru O6 |
|
_cod_database_code 1001397 |
|
_database_code_amcsd 0013638 |
|
5.6479 5.6672 7.9859 90 90.10 90 I2/c |
|
atom x y z occ |
|
Ba1 0 .499 .25 .5 |
|
La1 0 .499 .25 .5 |
|
Zn1 0 0 0 .5 |
|
Ru1 0 0 0 .5 |
|
O1 0 .043 .25 |
|
O2 .26 .752 .0190 |
|
|
| Download AMC data (View Text File)
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|
| |
|
Ba La O6 Ru Zn |
| |
Battle P, Gibb T, Jones C, Studer F |
| |
Journal of Solid State Chemistry 78 (1989) 281-293 |
|
Spin-Glass Behavior in Sr2 Fe Ru O6 and Ba La Ni Ru O6: A |
|
Comparison with Antiferromagnetic Ba La Zn Ru O6 |
|
_cod_database_code 1001398 |
|
_database_code_amcsd 0013639 |
|
5.6364 5.6621 7.9686 90 90.077 90 I2/c |
|
atom x y z occ |
|
Ba1 0 .501 .25 .5 |
|
La1 0 .501 .25 .5 |
|
Zn1 0 0 0 .5 |
|
Ru1 0 0 0 .5 |
|
O1 0 .0432 .25 |
|
O2 .261 .759 .0222 |
|
|
| Download AMC data (View Text File)
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|
| |
|
Fe O6 Ru Sr2 |
| |
Battle P, Gibb T, Jones C, Studer F |
| |
Journal of Solid State Chemistry 78 (1989) 281-293 |
|
Spin-Glass Behavior in Sr2 Fe Ru O6 and Ba La Ni Ru O6: A |
|
Comparison with Antiferromagnetic Ba La Zn Ru O6 |
|
_cod_database_code 1001399 |
|
_database_code_amcsd 0013640 |
|
5.5379 5.5429 7.8772 90 90.11 90 I2/c |
|
atom x y z occ |
|
Sr1 0 .5 .25 |
|
Fe1 0 0 0 .5 |
|
Ru1 0 0 0 .5 |
|
O1 0 .011 .25 |
|
O2 .228 .728 .0055 |
|
|
| Download AMC data (View Text File)
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|
| |
|
Fe O6 Ru Sr2 |
| |
Battle P, Gibb T, Jones C, Studer F |
| |
Journal of Solid State Chemistry 78 (1989) 281-293 |
|
Spin-Glass Behavior in Sr2 Fe Ru O6 and Ba La Ni Ru O6: A |
|
Comparison with Antiferromagnetic Ba La Zn Ru O6 |
|
_cod_database_code 1001400 |
|
_database_code_amcsd 0013641 |
|
5.5092 5.5138 7.8752 90 90.13 90 I2/c |
|
atom x y z occ |
|
Sr1 0 .501 .25 |
|
Fe1 0 0 0 .5 |
|
Ru1 0 0 0 .5 |
|
O1 0 .006 .25 |
|
O2 .219 .724 .0074 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Ba La Ni O6 Ru |
| |
Battle P, Gibb T, Jones C, Studer F |
| |
Journal of Solid State Chemistry 78 (1989) 281-293 |
|
Spin-Glass Behavior in Sr2 Fe Ru O6 and Ba La Ni Ru O6: A |
|
Comparison with Antiferromagnetic Ba La Zn Ru O6 |
|
_cod_database_code 1001401 |
|
_database_code_amcsd 0013642 |
|
5.6093 5.6154 7.9571 90 90.16 90 I2/c |
|
atom x y z occ |
|
Ba1 0 .498 .25 .5 |
|
La1 0 .498 .25 .5 |
|
Ni1 0 0 0 .5 |
|
Ru1 0 0 0 .5 |
|
O1 0 -.013 .25 |
|
O2 .222 .726 .0090 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Ba La Ni O6 Ru |
| |
Battle P, Gibb T, Jones C, Studer F |
| |
Journal of Solid State Chemistry 78 (1989) 281-293 |
|
Spin-Glass Behavior in Sr2 Fe Ru O6 and Ba La Ni Ru O6: A |
|
Comparison with Antiferromagnetic Ba La Zn Ru O6 |
|
_cod_database_code 1001402 |
|
_database_code_amcsd 0013643 |
|
5.5964 5.5879 7.9319 89.803 90.10 90.09 I-1 |
|
atom x y z occ |
|
Ba1 0 .501 .246 .5 |
|
La1 0 .501 .246 .5 |
|
Ni1 0 0 0 .5 |
|
Ru1 0 0 0 .5 |
|
Ni2 0 0 .5 .5 |
|
Ru2 0 0 .5 .5 |
|
O1 .016 -.015 .248 |
|
O2 .229 .726 .004 |
|
O3 -.213 .716 .492 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Er O6 Ru Sr2 |
| |
Battle P, Jones C, Studer F |
| |
Journal of Solid State Chemistry 90 (1991) 302-312 |
|
The crystal and magnetic structures of Ca2NdRuO6,Ca2HoRuO6 and |
|
Sr2ErRuO6 |
|
_cod_database_code 1001472 |
|
_database_code_amcsd 0013698 |
|
5.7626 5.7681 8.1489 90 90.19 90 P2_1/n |
|
atom x y z |
|
Sr1 .0065 .0256 .2482 |
|
Er1 .5 0 0 |
|
Ru1 .5 0 .5 |
|
O1 .2672 .2964 .0339 |
|
O2 .2021 .7697 .0332 |
|
O3 -.0670 .4876 .2365 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Er O6 Ru Sr2 |
| |
Battle P, Jones C, Studer F |
| |
Journal of Solid State Chemistry 90 (1991) 302-312 |
|
The crystal and magnetic structures of Ca2NdRuO6, Ca2HoRuO6 and |
|
Sr2ErRuO6 |
|
_cod_database_code 1001473 |
|
_database_code_amcsd 0013699 |
|
5.7500 5.7636 8.1354 90 90.22 90 P2_1/n |
|
atom x y z |
|
Sr1 .0079 .0305 .2498 |
|
Er1 .5 0 0 |
|
Ru1 .5 0 .5 |
|
O1 .2676 .2990 .0356 |
|
O2 .1984 .7707 .0354 |
|
O3 -.0696 .4865 .2354 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Ca2 Nd O6 Ru |
| |
Battle P, Jones C, Studer F |
| |
Journal of Solid State Chemistry 90 (1991) 302-312 |
|
The crystal and magnetic structures of Ca2NdRuO6, Ca2HoRuO6 and |
|
Sr2ErRuO6 |
|
_cod_database_code 1001474 |
|
_database_code_amcsd 0013700 |
|
5.5564 5.8296 8.0085 90 90.07 90 P2_1/n |
|
atom x y z occ |
|
Ca1 .5145 .5590 .2545 .5 |
|
Nd1 .5145 .5590 .2545 .5 |
|
Ca2 0 .5 0 |
|
Ru1 .5 0 0 |
|
O1 .2131 .1762 -.0514 |
|
O2 .3280 .7198 -.0664 |
|
O3 .3882 -.0494 .2291 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Ca2 Nd O6 Ru |
| |
Battle P, Jones C, Studer F |
| |
Journal of Solid State Chemistry 90 (1991) 302-312 |
|
The crystal and magnetic structures of Ca2NdRuO6, Ca2HoRuO6 and |
|
Sr2ErRuO6 |
|
_cod_database_code 1001475 |
|
_database_code_amcsd 0013701 |
|
5.5439 5.8282 7.9931 90 90.06 90 P2_1/n |
|
atom x y z occ |
|
Ca1 .5160 .5612 .2545 .5 |
|
Nd1 .5160 .5612 .2545 .5 |
|
Ca2 0 .5 0 |
|
Ru1 .5 0 0 |
|
O1 .2132 .1773 -.0523 |
|
O2 .3287 .7185 -.0671 |
|
O3 .3877 -.0501 .2291 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Ca2 Ho O6 Ru |
| |
Battle P, Jones C, Studer F |
| |
Journal of Solid State Chemistry 90 (1991) 302-312 |
|
The crystal and magnetic structures of Ca2NdRuO6, Ca2HoRuO6 and |
|
Sr2ErRuO6 |
|
_cod_database_code 1001476 |
|
_database_code_amcsd 0013702 |
|
5.4991 5.7725 7.9381 90 90.18 90 P2_1/n |
|
atom x y z occ |
|
Ca1 .5167 .5620 .2555 .73 |
|
Ho1 .5167 .5620 .2555 .27 |
|
Ca2 0 .5 0 .54 |
|
Ho2 0 .5 0 .46 |
|
O1 .2123 .1788 -.0545 |
|
O2 .3277 .7182 -.0678 |
|
O3 .3835 -.0518 .2303 |
|
Ru1 .5 0 0 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Ba Co1.6 Cu0.4 O5 Y |
| |
Barbey L, Nguyen N, Caignaert V, Studer F, Raveau B |
| |
Journal of Solid State Chemistry 112 (1994) 148-156 |
|
Spin state and variation of the spin orientation of Co(III) in the 112- |
|
type phase YBa(Co2-xCux)O5 |
|
_cod_database_code 1001607 |
|
_database_code_amcsd 0013825 |
|
3.8724 3.8724 7.4953 90 90 90 P4/mmm |
|
atom x y z occ |
|
Y1 0 0 .5 |
|
Ba1 0 0 0 |
|
Cu1 .5 .5 .2678 .2 |
|
Co1 .5 .5 .2678 .8 |
|
O1 .5 0 .3088 |
|
O2 .5 .5 0 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Ba Co1.2 Cu0.8 O5 Y |
| |
Barbey L, Nguyen N, Caignaert V, Studer F, Raveau B |
| |
Journal of Solid State Chemistry 112 (1994) 148-156 |
|
Spin state and variation of the spin orientation of Co(III) in the 112- |
|
type phase YBa(Co2-xCux)O5 |
|
_cod_database_code 1001608 |
|
_database_code_amcsd 0013826 |
|
3.8675 3.8675 7.5238 90 90 90 P4/mmm |
|
atom x y z occ |
|
Y1 0 0 .5 |
|
Ba1 0 0 0 |
|
Cu1 .5 .5 .2720 .4 |
|
Co1 .5 .5 .2720 .6 |
|
O1 .5 0 .3128 |
|
O2 .5 .5 0 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Ba Co1.1 Cu0.9 O5 Y |
| |
Barbey L, Nguyen N, Caignaert V, Studer F, Raveau B |
| |
Journal of Solid State Chemistry 112 (1994) 148-156 |
|
Spin state and variation of the spin orientation of Co(III) in the 112- |
|
type phase YBa(Co2-xCux)O5 |
|
_cod_database_code 1001609 |
|
_database_code_amcsd 0013827 |
|
3.8666 3.8666 7.5266 90 90 90 P4/mmm |
|
atom x y z occ |
|
Y1 0 0 .5 |
|
Ba1 0 0 0 |
|
Cu1 .5 .5 .2734 .45 |
|
Co1 .5 .5 .2734 .55 |
|
O1 .5 0 .3130 |
|
O2 .5 .5 0 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Bi0.5 Cu Hg0.5 O4.92 Sr2 |
| |
Pelloquin D, Michel C, Hervieu M, Studer F, Raveau B |
| |
Physica C 257 (1996) 195-209 |
|
On the crystal structure of the "1201" superconductors Hg0.5Bi0.5Sr2-xLaxCuO5-d |
|
_cod_database_code 1001759 |
|
_database_code_amcsd 0015075 |
|
3.7652 3.7652 8.9428 90 90 90 P4/mmm |
|
atom x y z occ |
|
Hg1 0 0 0 .5 |
|
Bi1 0 0 0 .5 |
|
Sr1 .5 .5 .2949 |
|
Cu1 0 0 .5 |
|
O1 .5 0 .5 .96 |
|
O2 0 0 .2256 |
|
O3 .257 .5 0 .13 |
|
O4 .397 .397 0 .12 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Bi0.5 Cu Hg0.5 La0.5 O5 Sr1.5 |
| |
Pelloquin D, Michel C, Hervieu M, Studer F, Raveau B |
| |
Physica C 257 (1996) 195-209 |
|
On the crystal structure of the "1201" superconductors Hg0.5Bi0.5Sr2-xLaxCuO5-d |
|
_cod_database_code 1001760 |
|
_database_code_amcsd 0015076 |
|
3.7769 3.7769 8.8252 90 90 90 P4/mmm |
|
atom x y z occ |
|
Hg1 0 0 0 .5 |
|
Bi1 0 0 0 .5 |
|
Sr1 .5 .5 .2929 .75 |
|
La1 .5 .5 .2929 .25 |
|
Cu1 0 0 .5 |
|
O1 .5 0 .5 |
|
O2 0 0 .2280 |
|
O3 .301 .5 0 .10 |
|
O4 .385 .385 0 .15 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
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