American Mineralogist Crystal Structure Database

19 matching records for this search.

Ba3 Cu6 La3 O14
 
Er-Rakho L, Michel C, Provost J, Raveau B
 
Journal of Solid State Chemistry 37 (1981) 151-156
A Series of Oxygen-Defect Perovskites Containing Cu(II) and Cu(III):
The Oxides La3-x Lnx Ba3 (Cu(II)5-2y Cu(III)1+2y) O14+y
_cod_database_code 1001172
_database_code_amcsd 0013414
5.5253 5.5253 11.721 90 90 90 P4/mmm
atom   x   y     z occ
La1    0  .5 .1798  .5
Ba1    0  .5 .1798  .5
La2    0  .5    .5  .5
Ba2    0  .5    .5  .5
Cu1    0   0     0
Cu2   .5  .5     0
Cu3    0   0  .348
Cu4   .5  .5  .346
O1   .25 .25     0
O2   .25 .25  .358
O3    .5  .5  .147
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Ba2 Ca Cu2 O7 Tl
 
Hervieu M, Maignan A, Martin C, Michel C, Provost J, Raveau B
 
Journal of Solid State Chemistry 75 (1988) 212-215
A New Member of the Thallium Superconductive Series. The "1212" Oxide
Tl Ba2 Ca Cu2 O8-y: Importance of Oxygen Content
_cod_database_code 1001367
_database_code_amcsd 0013619
3.833 3.833 12.68 90 90 90 P4/mmm
atom  x  y    z occ
Tl1  .5 .5   .5
Ba1   0  0 .287
Tl2   0  0    0  .1
Ca1   0  0    0  .9
Cu1  .5 .5 .130 .95
O1    0 .5 .125
O2   .5 .5 .323
O3    0  0   .5
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Ba0.92 Cu3 O8 Pb0.92 Sr1.15 Y1.15
 
Rouillon T, Retoux R, Groult D, Michel C, Hervieu M, Provost J, Raveau B
 
Journal of Solid State Chemistry 78 (1989) 322-325
PbBaYSrCu3O8: A New Member of the Intergrowth Family (ACuO3-x)m(A'O)n
_cod_database_code 1001403
_database_code_amcsd 0013644
3.842 3.842 27.66 90 90 90 I4/mmm
atom x  y    z  occ
Pb1  0  0 .290  .46
Ba1  0  0 .290  .46
Y1   0  0 .437 .575
Sr1  0  0 .437 .575
Cu1  0  0 .122
Cu2  0  0    0
O1   0 .5    0
O2   0  0   .2
O3   0 .5 .118
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Cu O5 Pr0.6 Sr1.6 Tl0.8
 
Bourgault D, Martin C, Michel C, Hervieu M, Provost J, Raveau B
 
Journal of Solid State Chemistry 78 (1989) 326-328
Tl1-x Prx Sr2-y Pry Cu O5-delta: First Member of the Family
Tl A2 Cam-1 Cum O2m+ (A= Ba, Sr)
_cod_database_code 1001404
_database_code_amcsd 0013645
3.741 3.741 8.875 90 90 90 P4/mmm
atom  x  y    z occ
Tl1   0  0   .5  .8
Pr1   0  0   .5  .2
Sr1  .5 .5 .205  .8
Pr2  .5 .5 .205  .2
Cu1   0  0    0
O1    0  0 .259
O2   .5 .5   .5
O3   .5  0    0
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Bi Cu2 O8 Pb Sr2 Y
 
Retoux R, Caignaert V, Provost J, Michel C, Hervieu M, Raveau B
 
Journal of Solid State Chemistry 79 (1989) 157-168
Superconducting properties and Structural Study of
Bi2-xPbxSr2Ca1-xYxCu2O8 (0< x< 1)
_cod_database_code 1001409
_database_code_amcsd 0013649
5.385 5.424 30.316 90 90 90 Fmmm
atom   x   y     z occ
Bi1    0   0 .2018  .5
Pb1    0   0 .2018  .5
Sr1    0   0 .6147
Y1     0   0    .5
Cu1    0   0 .0554
O1   .25 .25  .049
O2     0   0  .686
O3     0   0  .133
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Cu2 O6.6 Pb0.5 Sr2.5 Y
 
Rouillon T, Provost J, Hervieu M, Groult D, Michel C, Raveau B
 
Journal of Solid State Chemistry 84 (1990) 375-385
The solid solution Pb0.5Sr2.5Y1-xCaxCu2O7-d:
Superconductivity and structure
_cod_database_code 1001442
_database_code_amcsd 0013674
3.8253 3.8253 11.891 90 90 90 P4/mmm
atom  x  y     z occ
Pb1  .5 .5    .5  .5
Sr1  .5 .5    .5  .5
Sr2   0  0 .2891
Y1    0  0     0
Cu1  .5 .5 .1391
O1    0 .5 .1235
O2   .5 .5  .308  .8
O3    0  0    .5
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Ba2 Ca Cu2 O8 Tl2
 
Michel C, Martin C, Hervieu M, Maignan A, Provost J, Huve M, Raveau B
 
Journal of Solid State Chemistry 96 (1992) 271-286
Thallium nonstoichiometry in 2212-thallium cuprate
_cod_database_code 1001532
_database_code_amcsd 0013724
3.8565 3.8565 29.3122 90 90 90 I4/mmm
atom  x  y     z  occ
Tl1  .5 .5 .2134 .915
Ca1  .5 .5 .2134 .085
Ba1   0  0 .1216
Ca2   0  0     0  .83
Tl2   0  0     0  .17
Cu1  .5 .5 .0535
O1    0 .5 .0508
O2   .5 .5 .1428
O3   .5 .5 .2793
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Ba2 Ca Cu2 O8 Tl1.81
 
Michel C, Martin C, Hervieu M, Maignan A, Provost J, Huve M, Raveau B
 
Journal of Solid State Chemistry 96 (1992) 271-286
Thallium nonstoichiometry in 2212-thallium cuprate
_cod_database_code 1001533
_database_code_amcsd 0013725
3.8489 3.8489 29.3153 90 90 90 I4/mmm
atom  x  y     z  occ
Tl1  .5 .5 .2132 .860
Ca1  .5 .5 .2132 .045
Ba1   0  0 .1213
Ca2   0  0     0  .91
Tl2   0  0     0  .09
Cu1  .5 .5 .0545
O1    0 .5 .0510
O2   .5 .5 .1461
O3   .5 .5 .2838
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Li Mo O8 P2
 
Ledain S, Borel M, Leclaire A, Provost J, Raveau B
 
Journal of Solid State Chemistry 120 (1995) 260-267
A molybdenum V diphosphate involving Li O4 tetrahedra: Li Mo O P2 O7
_cod_database_code 1001713
_database_code_amcsd 0013878
16.04599 11.951 9.937 90 104.62 90 P2_1/n
atom      x      y     z
Mo1  .23712 .19528 .1878
Mo2  .57656 .21664 .1992
Mo3  .90907  .2023 .1932
P1    .1195  .2968 .3854
P2    .1595  .4500 .1895
P3    .4787  .4582 .1817
P4    .4419  .3008 .3816
P5    .3387  .0415 .7148
P6    .3767  .1741 .9715
Li1    .022   .436  .902
Li2    .212   .064  .439
Li3    .355   .443  .903
O1    .1542   .135  .079
O2    .3140   .191  .061
O3    .2846  .0538  .295
O4    .1870  .2146  .355
O5    .2051  .3546  .135
O6    .3494  .2736  .324
O7    .6643   .272  .302
O8    .6309  .1934 .0412
O9    .5002  .2141  .333
O10   .5954   .051  .268
O11   .5200  .3601  .124
O12   .4652  .1427  .054
O13   .8159  .1470  .110
O14   .9692  .1905  .038
O15   .9523  .0529  .283
O16   .8735  .2235  .377
O17   .8793  .3633  .149
O18   .0307  .2707  .301
O19   .1486  .4164  .340
O20   .0707  .4723  .097
O21   .4651  .4197  .329
O22   .3981   .490  .085
O23   .3373  .0736  .870
O24   .2504  .0120  .634
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O9 P2 Sr V2
 
Boudin S, Grandin A, Labbe P, Provost J, Raveau B
 
Journal of Solid State Chemistry 127 (1996) 325-330
The V(III) monophosphate series A V2 O (P O4)2 with A = Cd, Ca, Sr:
structure and magnetism
_cod_database_code 1001748
_database_code_amcsd 0013913
14.220 6.5138 7.5166 90 90 90 Pnma
atom      x     y     z
Sr1  .21944   .25 .1229
V1    .3821   .75 .1532
V2        0    .5     0
P1    .1892   .75 .1119
P2    .4389   .25 .1450
O1    .3744  .437 .1372
O2    .2648   .75 -.032
O3    .4864   .75 -.005
O4    .2496   .75  .281
O5    .4452   .75  .376
O6   -.0111   .25  .171
O7    .1266 .5607 .1026
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Cs Mo8 O33 P4
 
Hoareau T, Leclaire A, Borel M, Provost J, Raveau B
 
Journal of Solid State Chemistry 128 (1997) 233-240
A mixed valent molybdenum monophosphate with an original cage structure
Cs Mo6 O10 (Mo2 O7) (P O4)4
_cod_database_code 1001806
_database_code_amcsd 0013917
9.953 9.953 26.41299 90 90 90 I-42d
atom     x     y      z occ
Mo1  .1809 .1847 .00729
Mo2  .4785  .504 .10915  .5
Mo3  .1412 .6237 .11410  .5
Cs1      0    .5 .09897  .5
P1   .4905 .2192  .0420
O1    .002 .1824 -.0126
O2    .169  .226  .0684
O3    .198  .374 -.0213
O4    .385  .180  .0029
O5    .215  .131 -.0754
O6   .4700 .3660  .0574
O7    .305  .545  .1101
O8    .532  .633  .1606
O9       0    .5 .09897  .5
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K2 O15 P4 V2
 
Borel M, Leclaire A, Chardon J, Provost J, Rebbah H, Raveau B
 
Journal of Solid State Chemistry 132 (1997) 41-46
A V(IV) tetraphosphate with a tunnel structure K2 (V O)2 P4 O13
_cod_database_code 1001813
_database_code_amcsd 0013933
22.181 11.564 9.548 90 90 90 Pbca
atom      x      y      z
V1    .0304  .1198  .2578
V2   .22498 -.0687 -.0163
P1    .0299  .3814  .1254
P2    .1131  .5596  .2191
P3    .3086  .1510 -.0201
P4    .1675  .0270  .2708
K1   -.0619  .1544 -.0661
K2    .1351  .1998 -.0365
O1    .0361  .0856  .0959
O2    .0204 -.0394  .3326
O3    .1190  .1151  .2973
O4    .0416  .2917  .2393
O5   -.0608  .1418  .2559
O6    .0239  .1714  .4821
O7    .2759  .8834  .0824
O8    .2712 -.0729  .8050
O9    .1626 -.0253  .1262
O10   .1839  .7760 -.0516
O11   .2459  .1038 -.0141
O12   .1446 -.0163  .8443
O13   .0915  .4573  .1211
O14   .3410  .1299  .1257
O15   .3470  .0796  .8751
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Li3 Mo3 O17 P3
 
Ledain S, Leclaire A, Borel M, Provost J, Raveau B
 
Journal of Solid State Chemistry 133 (1997) 391-399
A mixed valent molybdenum monophosphate with a bidimensional connection
of Mo O6 octahedra : Li3 Mo3 O5 (P O4)3
_cod_database_code 1001815
_database_code_amcsd 0013940
11.946 12.716 8.274 90.26 96.87 89.67 P-1
atom      x      y      z
Mo1  .01512 .11443  .2432
Mo2  .98654 .61433  .2598
Mo3  .47862 .61937  .1838
Mo4  .60568 .87233  .1510
Mo5  .39953 .37028 .34479
Mo6  .52314 .11880  .3206
P1    .7322  .4038  .5956
P2   -.0546  .3621  .1420
P3    .0546  .8614  .3582
P4    .2716  .1558  .4417
P5    .2725  .3515 -.0582
P6    .7357  .0940  .1005
O1    .0742  .0924   .074
O2   -.0649  .1536  .4557
O3    .8568  .1346  .1374
O4    .1586  .1050  .3959
O5    .0250  .2747  .2306
O6   -.0144 -.0365  .3029
O7   -.0737  .5935  .4302
O8    .0660  .6535  .0438
O9    .0173  .4632  .1981
O10   .1447  .6314  .3650
O11  -.0255  .7748  .2707
O12   .8452  .6050  .1058
O13   .4232  .6050  -.011
O14   .5459  .6367  .4559
O15   .3295  .6463  .2668
O16   .6456  .5912  .1635
O17   .4786  .4788  .2753
O18   .5173  .7611  .1917
O19   .5498  .8937  -.046
O20   .6986  .8450  .3775
O21   .5387  .9764  .2628
O22   .7375  .9742  .1279
O23   .7271  .7675  .0873
O24   .3049  .3778   .116
O25   .2686  .2707  .3784
O26   .4751  .2615  .2708
O27   .2739  .4752  .3916
O28   .5806  .1251   .516
O29   .3589  .0893  .3565
O30   .6692  .1488  .2291
O31   .6862  .3640  .4304
O32   .8320  .3620   .200
O33   .1680  .8599   .298
O34   .6899  .1249 -.0699
Li1    .142   .377   .343
Li2    .860   .872   .155
Li3    .795   .254   .355
Li4    .692   .434   .229
Li5    .303  -.065   .278
Li6    .206   .754   .145
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Li Mo3 O16 P3
 
Hoareau T, Borel M, Leclaire A, Provost J, Raveau B
 
Materials Research Bulletin 30 (1995) 523-529
Structure and antiferromagnetic properties of a mixed valent molybdeno
monophosphate of lithium
_cod_database_code 1001635
_database_code_amcsd 0014371
6.374 7.709 12.529 80.03 77.62 81.80 P-1
atom      x      y      z
Mo1  .20441 .21091 .53075
Mo2  .40945 .74102 .16096
Mo3  .03722 .19637 .15127
Li1    .586   .327   .328
P1   .55902 .15595 .11041
P2   .31114 .84135 .42733
P3   .05684 .48506 .31352
O1    .1981  .0453  .6355
O2   -.0987  .2284  .5128
O3    .5244  .2478     .5
O4    .2952  .0431  .4150
O5    .1342  .4158  .6163
O6    .2327  .3988  .3781
O7    .0623  .2886  .0190
O8   -.0490  .3437  .2734
O9    .7154  .1913  .1819
O10   .1191 -.0255  .1513
O11   .3347  .2344  .1655
O12   .6072  .5774  .1661
O13   .3728  .7471  .0057
O14   .1532  .6077  .2097
O15   .3816  .7895  .3130
O16   .5671  .9580  .1095
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Ca0.91 Cu2 O7 Pb0.5 Sr2 Tl0.59
 
Martin C, Provost J, Bourgault D, Domenges B, Michel C, Hervieu M, Raveau B
 
Physica C 157 (1989) 460-468
Structural peculiarities of the "1212" superconductor Tl.5Pb.5Sr2CaCu2O5
_cod_database_code 1001411
_database_code_amcsd 0015013
3.795 3.795 12.094 90 90 90 P4/mmm
atom   x   y     z occ
Tl1   .5  .5    .5 .48
Pb1   .5  .5    .5  .5
Ca1   .5  .5    .5 .02
Sr1    0   0 .2808
Ca2    0   0     0 .89
Tl2    0   0     0 .11
Cu1   .5  .5  .135
O1     0  .5  .135
O2    .5  .5  .305
O3   .08 .08    .5 .25
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Ca0.5 Cu2 O6.3 Pb0.46 Sr2.46 Y0.5
 
Rouillon T, Provost J, Hervieu M, Groult D, Michel C, Raveau B
 
Physica C 159 (1989) 201-209
Superconductivity up to 100 K in lead cuprates: A new superconductor
Pb.5 Sr2.5 Y.5 Ca.5 Cu2 O7-delta
_cod_database_code 1001412
_database_code_amcsd 0015015
3.817 3.817 11.907 90 90 90 P4/mmm
atom  x  y     z occ
Pb1  .5 .5    .5 .46
Sr1  .5 .5    .5 .46
Sr2   0  0 .2890
Y1    0  0     0  .5
Ca1   0  0     0  .5
Cu1  .5 .5 .1362
O1    0 .5  .127
O2   .5 .5  .318 .65
O3    0  0    .5
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Cu La O5 Sr Tl
 
Huve M, Michel C, Martin C, Hervieu M, Maignan A, Provost J, Raveau B
 
Physica C 179 (1991) 214-226
The "1201"-phase of the "Tl-Sr-La-Cu-O" system. Homogeneity range,
structure and superconductivity
_cod_database_code 1001487
_database_code_amcsd 0015026
3.7796 3.7796 8.8466 90 90 90 P4/mmm
atom  x  y     z occ
Tl1   0  0    .5
Sr1  .5 .5 .2058  .5
La1  .5 .5 .2058  .5
Cu1   0  0     0
O1    0  0  .263
O2   .5 .5    .5
O3   .5  0     0
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Cu La0.6 O5 Sr1.4 Tl
 
Huve M, Michel C, Martin C, Hervieu M, Maignan A, Provost J, Raveau B
 
Physica C 179 (1991) 214-226
The "1201"-phase of the "Tl-Sr-La-Cu-O" system. Homogeneity range,
structure and superconductivity
_cod_database_code 1001488
_database_code_amcsd 0015027
3.7535 3.7535 8.9038 90 90 90 P4/mmm
atom  x  y     z occ
Tl1   0  0    .5
Sr1  .5 .5 .2061  .7
La1  .5 .5 .2061  .3
Cu1   0  0     0
O1    0  0  .259
O2   .5 .5    .5
O3   .5  0     0
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Cu La0.7 O5 Sr Tl1.3
 
Huve M, Michel C, Martin C, Hervieu M, Maignan A, Provost J, Raveau B
 
Physica C 179 (1991) 214-226
The "1201"-phase of the "Tl-Sr-La-Cu-O" system. Homogeneity range,
structure and superconductivity
_cod_database_code 1001489
_database_code_amcsd 0015028
3.7713 3.7713 8.8676 90 90 90 P4/mmm
atom  x  y     z occ
Tl1   0  0    .5
Sr1  .5 .5 .2044  .5
La1  .5 .5 .2044 .35
Tl2  .5 .5 .2044 .15
Cu1   0  0     0
O1    0  0  .281
O2   .5 .5    .5
O3   .5  0     0
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Total number of retrieved datasets: 19
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