American Mineralogist Crystal Structure Database

12 matching records for this search.

Cu O12 P3 Zr2
 
Bussereau I, Belkhiria M, Gravereau P, Boireau A, Soubeyroux J,
Olazcuaga R, Le Flem G
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-2701&volume=48&spage=1741
Acta Crystallographica C48 (1992) 1741-1744
Structure of CuZr2(PO4)3 by X-ray and neutron powder diffraction
_cod_database_code 1008577
_database_code_amcsd 0016468
8.9018 8.9018 22.2021 90 90 120 R-3c
atom     x      y     z   occ
Cu1  .0454 -.0977 .0007 .1667
Zr1      0      0 .1419
P1   .2861      0   .25
O1   .1839 -.0082 .1915
O2   .1949    1/6 .0832
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Cu O12 P3 Zr2
 
Bussereau I, Belkhiria M, Gravereau P, Boireau A, Soubeyroux J,
Olazcuaga R, Le Flem G
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-2701&volume=48&spage=1741
Acta Crystallographica C48 (1992) 1741-1744
Structure of CuZr2(PO4)3 by X-ray and neutron powder diffraction
_cod_database_code 1008578
_database_code_amcsd 0016469
8.892 8.892 22.190 90 90 120 R-3c
atom    x     y    z   occ
Cu1  .046 -.093    0 .1667
Zr1     0     0 .142
P1   .286     0  .25
O1   .187 -.009 .194
O2   .198  .171 .085
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Cu0.5 O12 P3 Ti2
 
Olazcuaga R, Le Flem G, Boireau A, Soubeyroux J
 
Advanced Materials Research 1 (1994) 177-188
The structure of the high temperature forms of Cu(II)0.5 Ti2 (P O4)3
and D0.5 Cu(I)0.5 Zr2 (P O4)3
_cod_database_code 1008727
_database_code_amcsd 0016608
8.46 8.46 21.879990000 90 90 120 R-3
atom     x      y     z  occ
Cu1   .431   .103 .3685 .167
Ti1      0      0 .1452
Ti2      0      0 .6421
P1   .2863  .0023 .2508
O1   .1783 -.0147 .1934
O2   .7931  .9450 .6946
O3   .2784  .8226 .2621
O4   .5193  .8456 .7556
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Cu0.516 D0.36 O12 P3 Zr2
 
Olazcuaga R, Le Flem G, Boireau A, Soubeyroux J
 
Advanced Materials Research 1 (1994) 177-188
The structure of the high temperature forms of Cu(II)0.5 Ti2 (P O4)3
and D0.5 Cu(I)0.5 Zr2 (P O4)3
_cod_database_code 1008728
_database_code_amcsd 0016609
8.84 8.84 22.31 90 90 120 R-3c
atom     x      y     z  occ
Cu1  -.023   .121  .006 .086
D1    .374   .502  .120 .060
Zr1      0      0 .1408
P1   .2825      0   .25
O1   .1789 -.0198 .1956
O2   .2007  .1721 .0881
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Cr Cu2 O12 P3 Zr
 
Boireau A, Soubeyroux J, Gravereau P, Olazcuaga R, Le Flem G
 
European Journal of Solid State and Inorganic Chemistry 30 (1993) 337-346
Evidence of copper pairing in Cu2^I^CrZr(PO4/4)3, a crystallographic study
_cod_database_code 1008543
_database_code_amcsd 0016434
8.7449 8.7449 21.819 90 90 120 R-3c
atom     x      y     z   occ
Cu1   .039   .156 .0046  .260
Cu2   .650   .074  .295 .0733
Zr1      0      0 .1413    .5
Cr1      0      0 .1413    .5
P1   .2884      0   .25
O1   .1830 -.0113 .1931
O2   .1959  .1697 .0849
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F5 H2 Mn O Tl2
 
Nunez P, Tressaud A, Darriet J, Hagenmuller P, Hahn G, Frenzen G,
Massa W, Babel D, Boireau A, Soubeyroux J
 
Inorganic Chemistry 31 (1992) 770-774
A new linear chain compound: crystal and magnetic structures of
Tl2MnF5.H2O
_cod_database_code 1008532
_database_code_amcsd 0016425
9.688 8.002 8.339 90 90 90 Cmcm
atom      x      y     z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Tl1  .20826 .29754   .25  .0252  .0232  .0235 -.0059      0      0
Mn1       0      0     0  .0141  .0092  .0116      0      0  .0007
F1        0 -.0006   .25   .057   .056   .008      0      0      0
F2    .1876      0     0   .028   .034   .032      0      0   .013
F3        0  .2305 .0043   .043   .022   .029      0      0   .003
O1       .5  .0507   .25   .053   .025   .026      0      0      0
H1       .5  .1118 .1666
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F5 H2 Mn O Tl2
 
Nunez P, Tressaud A, Darriet J, Hagenmuller P, Hahn G, Frenzen G,
Massa W, Babel D, Boireau A, Soubeyroux J
 
Inorganic Chemistry 31 (1992) 770-774
A new linear chain compound: crystal and magnetic structures of
Tl2MnF5.H2O
_cod_database_code 1008533
_database_code_amcsd 0016426
9.526 7.861 8.317 90 90 90 Cmcm
atom     x     y    z
Tl1  .2093 .2961  .25
Mn1      0     0    0
F1       0 -.014  .25
F2    .191     0    0
F3       0  .239 .015
O1      .5  .056  .25
H1      .5  .126 .152
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Cr Cu2 O12 P3 Zr
 
Boireau A, Soubeyroux J, Gravereau P, Olazcuaga R, Le Flem G
 
Journal of Alloys and Compounds 188 (1992) 113-116
Structure of Cu^I^2CrZr(PO4)3 by powder neutron diffraction
_cod_database_code 1008589
_database_code_amcsd 0016480
8.7449 8.7449 21.819 90 90 120 R-3c
atom     x      y     z   occ
Cu1   .039   .156 .0046  .260
Cu2   .650   .074  .295 .0733
Zr1      0      0 .1413    .5
Cr1      0      0 .1413    .5
P1   .2884      0   .25
O1   .1830 -.0113 .1931
O2   .1959  .1697 .0849
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Al Co F7 Na2
 
Boireau A, Gravereau P, Dance J, Tressaud A, Hagenmuller P, Soubeyroux J,
Welsch M, Babel D
 
Materials Research Bulletin 28 (1993) 27-38
Structural and magnetic properties of several cobalt(II) weberites
_cod_database_code 1008866
_database_code_amcsd 0016734
12.378 7.210 24.019 90 99.67 90 C2/c
atom      x      y      z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Na1       0      0      0  .0345  .0214  .0350 -.0030 -.0079 -.0124
Na2       0     .5      0  .0277  .0442  .0453  .0063  .0159  .0183
Na3     .25    .25     .5  .0549  .0432  .0656  .0188  .0299  .0227
Na4       0  .7853    .25  .0387  .0268  .0478      0  .0201      0
Na5   .2531  .0456 .25339  .0238  .0218  .0276  .0044  .0011  .0085
Na6   .3732  .5089 .12145  .0317  .0474  .0142  .0017 -.0002 -.0104
Co1  .37760 .01138 .12761  .0077  .0088  .0091 -.0001  .0016 -.0005
Co2  .12666 .26382 .12600  .0083  .0079  .0086 -.0004  .0022  .0000
Al1     .25    .25      0  .0091  .0111  .0051 -.0003  .0020 -.0009
Al2       0  .2522    .25  .0086  .0098  .0062      0  .0015      0
Al3   .1264  .7651 .12584  .0075  .0063  .0097 -.0010  .0012  .0003
F1    .3320  .0930  .0470  .0190  .0252  .0133 -.0058  .0004 -.0087
F2    .1497  .2767  .0454  .0178  .0254  .0145 -.0041  .0094 -.0032
F3    .3277  .4493  .0313  .0202  .0207  .0142  .0058  .0016  .0026
F4    .0775  .0751  .2907  .0185  .0175  .0133 -.0040  .0002 -.0050
F5    .1051  .2580  .2067  .0163  .0249  .0125 -.0013  .0080 -.0015
F6    .4242 -.0628  .2092  .0194  .0192  .0148  .0052  .0009  .0057
F7    .2618 -.1845  .1126  .0108  .0177  .0263 -.0046  .0056 -.0002
F8    .4917  .2118  .1401  .0118  .0170  .0262  .0046  .0055  .0005
F9    .1738  .5305  .1401  .0178  .0078  .0228  .0005  .0012  .0008
F10   .0877  .7210  .0511  .0216  .0182  .0136 -.0039 -.0014 -.0037
F11   .0783 -.0015  .1115  .0182  .0083  .0220  .0016  .0010  .0019
F12   .1652  .8109  .2008  .0191  .0153  .0130  .0004 -.0010 -.0021
F13  -.0296  .3255  .0948  .0110  .0179  .0193  .0046  .0028 -.0019
F14   .2827  .1996  .1582  .0120  .0164  .0193 -.0034  .0027  .0029
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F4 H2 Mn O Tl
 
Nunez P, Tressaud A, Hahn F, Massa W, Babel D, Boireau A, Soubeyroux J
 
Physica Status Solidi 127 (1991) 505-517
A new 1D-antiferromagnet: crystal and magnetic structures of TlMnF4.H2O
_cod_database_code 1008574
_database_code_amcsd 0016465
13.784 6.631 10.537 90 103.66 90 C2/c
atom      x      y      z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Tl1  .08176 .73833 .43518  .0285  .0240  .0292  .0010  .0038 -.0010
Mn1     .25    .25     .5  .0109  .0143  .0163 -.0004  .0012  .0006
Mn2       0  .2443    .25  .0115  .0147  .0175      0  .0041      0
F1    .1088  .2515  .4356   .014   .041   .019   .000  -.001   .003
F2    .2512 -.0178  .4632   .029   .019   .040  -.003   .007  -.003
F3    .0688  .0494  .1852   .021   .028   .041   .009   .007  -.010
F4    .0707  .4385  .1870   .024   .030   .029  -.003   .009   .014
O1    .2692  .3296  .3036   .021   .031   .025  -.009   .000   .009
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F4 H2 Mn O Tl
 
Nunez P, Tressaud A, Hahn F, Massa W, Babel D, Boireau A, Soubeyroux J
 
Physica Status Solidi 127 (1991) 505-517
A new 1D-antiferromagnet: crystal and magnetic structures of TlMnF4.H2O
_cod_database_code 1008575
_database_code_amcsd 0016466
13.6775 6.5865 10.3890 90 103.176 90 C2/c
atom     x      y     z
Tl1  .0803  .7355 .4345
Mn1    .25    .25    .5
Mn2      0   .264   .25
F1   .1072   .255 .4395
F2   .2493 -.0160 .4657
F3   .0712  .0444 .1857
F4   .0697  .4406 .1880
O1   .2658  .3260 .2985
H1   .3200   .394  .293
H2   .2021   .373  .249
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F4 H2 Mn O Rb
 
Nunez P, Tressaud A, Hahn F, Massa W, Babel D, Boireau A, Soubeyroux J
 
Physica Status Solidi 127 (1991) 505-517
A new 1D-antiferromagnet: crystal and magnetic structures of TlMnF4.H2O
_cod_database_code 1008576
_database_code_amcsd 0016467
13.838 6.429 10.486 90 103.97 90 C2/c
atom    x     y    z
Rb1  .075  .753 .440
Mn1   .25   .25   .5
Mn2     0  .219  .25
F1   .108  .252 .448
F2   .256 -.021 .465
F3   .078  .039 .199
F4   .069  .464 .191
O1   .261  .323 .293
H1   .318  .413 .302
H2   .218  .392 .253
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Total number of retrieved datasets: 12
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