American Mineralogist Crystal Structure Database

22 matching records for this search.

Ba S3 V
 
Ghedira M, Chenavas J, Sayetat F, Marezio M, Massenet O, Mercier J
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-7681&volume=37&spage=1491
Acta Crystallographica B37 (1981) 1491-1496
Structural aspects of the hexagonal to orthorhombic transition in
stoichiometric Ba V S3
_cod_database_code 1008062
_database_code_amcsd 0016004
6.7283 6.7283 5.6263 90 90 120 P6_3/mmc
atom      x      y   z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ba1     1/3    2/3 .75 .01006 .01006 .01320 .00503      0      0
V1        0      0   0  .0266  .0266  .0113  .0133      0      0
S1   .16531 .33062 .25  .0105  .0077  .0138  .0038      0      0
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Os3.32 Si0.68 U2
 
Verniere A, Lejay P, Bordet P, Chenavas J, Brison J, Haen P, Boucherle J
 
Journal of Alloys and Compounds 209 (1994) 251-255
Crystal structures and physical properties of some new ternary
compounds U2 T3X (T= Ru, Os; X= Si, Ge)
_cod_database_code 1008673
_database_code_amcsd 0016559
7.436 7.436 7.436 90 90 90 *Fd3m
.125 .125 .125
atom    x    y    z occ
U1   .125 .125 .125
Os1    .5   .5   .5 .83
Si1    .5   .5   .5 .17
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Ru2.83 Si1.17 U2
 
Verniere A, Lejay P, Bordet P, Chenavas J, Brison J, Haen P, Boucherle J
 
Journal of Alloys and Compounds 209 (1994) 251-255
Crystal structures and physical properties of some new ternary
compounds U2 T3X (T= Ru, Os; X= Si, Ge)
_cod_database_code 1008858
_database_code_amcsd 0016724
5.501 5.501 11.367 90 90 120 R-3m
atom  x y      z  occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
U1    0 0 .12290       .0150  .0150  .0101  .0075      0      0
Ru1  .5 0      0 .943  .0112  .0054  .0091  .0027  .0004  .0008
Si1  .5 0      0 .057  .0112  .0054  .0091  .0027  .0004  .0008
Si2   0 0     .5        .022   .022   .018   .011      0      0
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Er4 Ir13 Si9
 
Verniere A, Lejay P, Bordet P, Chenavas J, Tholence J, Boucherle J, Keller N
 
Journal of Alloys and Compounds 218 (1995) 197-203
Crystal structure and physical properties of new ternary silicides R4T13X9
(R, rare earth or uranium; T, rhodium or iridium; X, silicon or germanium)
_cod_database_code 1008678
_database_code_amcsd 0016564
18.84799 10.918 3.9153 90 90 90 *Pnmm
0 .25 .25
atom      x     y   z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Er1  .79224 .0592 .25  .0071  .0104  .0052  .0015      0      0
Er2   .4804   .75 .25  .0073  .0076  .0051      0      0      0
Er3   .9784   .25 .25  .0061  .0085  .0052      0      0      0
Ir1  .66439 .0664 .75  .0041  .0060  .0029  .0000      0      0
Ir2  .85797   .25 .75  .0023  .0079  .0195      0      0      0
Ir3  .65711   .25 .25  .0052  .0058  .0044      0      0      0
Ir4  .22752   .25 .75  .0024  .0067  .0032      0      0      0
Ir5  .46076 .0607 .25  .0018  .0071  .0042  .0002      0      0
Ir6  .04654 .0496 .75  .0041  .0076  .0028 -.0013      0      0
Ir7  .85708 .8743 .75  .0031  .0061  .0028 -.0010      0      0
Ir8  .64473 .8777 .25  .0043  .0055  .0044  .0000      0      0
Si1   .6016   .75 .75
Si2   .5844 .4304 .25
Si3   .9183 .0611 .75
Si4   .8975   .75 .25
Si5   .2708 .3778 .25
Si6   .2666   .75 .25
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Ce Ir3 Si2
 
Verniere A, Lejay P, Bordet P, Chenavas J, Tholence J, Boucherle J, Keller N
 
Journal of Alloys and Compounds 218 (1995) 197-203
Crystal structure and physical properties of new ternary silicides R4T13X9
(R, rare earth or uranium; T, rhodium or iridium; X, silicon or germanium)
_cod_database_code 1008679
_database_code_amcsd 0016565
7.1838 9.7373 5.6018 90 90 90 Imma
atom     x     y     z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ce1      0   .25 .7201  .0071  .0104  .0052  .0015      0      0
Ir1  .2817     0     0  .0073  .0076  .0051      0      0      0
Ir2    .25   .25   .25  .0061  .0085  .0052      0      0      0
Si1      0 .0749 .1956  .0041  .0060  .0029  .0000      0      0
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Ba S3 V
 
Ghedira M, Anne M, Chenavas J, Marezio M, Sayetat F
 
Journal of Physics C: Solid State Physics 19 (1986) 6489-6503
Powder neutron diffraction studies of the low-temperature phase
transitions in stoichiometric Ba V S3
_cod_database_code 1008374
_database_code_amcsd 0016284
6.7572 11.4866 5.5994 90 90 90 Cmcm
atom     x     y   z
Ba1      0 .3364 .25
V1       0     0   0
S1       0 .8303 .25
S2   .2436 .0835 .25
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Ba S3 V
 
Ghedira M, Anne M, Chenavas J, Marezio M, Sayetat F
 
Journal of Physics C: Solid State Physics 19 (1986) 6489-6503
Powder neutron diffraction studies of the low-temperature phase
transitions in stoichiometric Ba V S3
_cod_database_code 1008375
_database_code_amcsd 0016285
6.7572 11.4866 5.5994 90 90 90 Cmc2_1
atom     x     y     z
Ba1      0 .3364   .25
V1       0  .021 -.001
S1       0 .8302  .237
S2   .2442 .0834  .258
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Ba S3 V
 
Ghedira M, Anne M, Chenavas J, Marezio M, Sayetat F
 
Journal of Physics C: Solid State Physics 19 (1986) 6489-6503
Powder neutron diffraction studies of the low-temperature phase
transitions in stoichiometric Ba V S3
_cod_database_code 1008376
_database_code_amcsd 0016286
6.7572 11.4866 5.5994 90 90 90 C222_1
atom     x     y     z
Ba1      0 .3363   .25
V1   -.012     0     0
S1       0 .8303   .25
S2   .2442 .0835 .2613
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Ba S3 V
 
Ghedira M, Anne M, Chenavas J, Marezio M, Sayetat F
 
Journal of Physics C: Solid State Physics 19 (1986) 6489-6503
Powder neutron diffraction studies of the low-temperature phase
transitions in stoichiometric Ba V S3
_cod_database_code 1008377
_database_code_amcsd 0016287
6.7192 6.7192 5.6188 90 90 120 P6_3/mmc
atom     x    y   z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
S1   .1655 .331 .25  .0192  .0139  .0251  .0080      0      0
V1       0    0   0  .0565  .0565  .0067  .0283      0      0
Ba1    1/3  2/3 .25  .0223  .0223  .0272  .0111      0      0
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Cu3 Mn4 O12 Th
 
Deschizeaux M, Loubert J, Vegas A, Collomb A, Chenavas J, Marezio M
 
Journal of Solid State Chemistry 19 (1976) 45-51
Synthetis and crystal structure of (Th Cu3) ((Mn2)^3+^ (Mn2)^4+^)O12,
a new ferrimagnetic Perovskite-like compound
_cod_database_code 1008192
_database_code_amcsd 0016129
7.359 7.359 7.359 90 90 90 Im3
atom     x     y   z
Th1      0     0   0
Cu1      0    .5  .5
Mn1    .25   .25 .25
O1   .2988 .1771   0
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Ca Cu3 O12 Ti4
 
Bochu B, Deschizeaux M, Joubert J, Collomb A, Chenavas J, Marezio M
 
Journal of Solid State Chemistry 29 (1979) 291-298
Synthese et caracterisation d'une serie de titanates Perowskites
isotypes de (Ca Cu3) (Mn4) O12
_cod_database_code 1008180
_database_code_amcsd 0016117
7.391 7.391 7.391 90 90 90 Im3
atom     x     y   z
Ca1      0     0   0
Cu1      0    .5  .5
Ti1    .25   .25 .25
O1   .3038 .1786   0
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Cu3 O12 Tb0.71 Ti4
 
Bochu B, Deschizeaux M, Joubert J, Collomb A, Chenavas J, Marezio M
 
Journal of Solid State Chemistry 29 (1979) 291-298
Synthese et caracterisation d'une serie de titanates Perowskites
isotypes de (Ca Cu3) (Mn4) O12
_cod_database_code 1008181
_database_code_amcsd 0016118
7.383 7.383 7.383 90 90 90 Im3
atom     x     y   z occ
Tb1      0     0   0 .71
Cu1      0    .5  .5
Ti1    .25   .25 .25
O1   .3030 .1797   0
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Ba2 Cu4 O8.06 Y
 
Karpinski J, Kaldis E, Rusiecki S, Jilek E, Fischer P, Bordet P, Chaillout C,
Chenavas J, Hodeau J, Marezio M
 
Journal of the Less-Common Metals 150 (1989) 129-137
Two New Bulk Superconducting Phases in the Y-Ba-Cu-O System: Y Ba2
Cu3.5 O7+x (Tc 40K) and Y Ba2 Cu4 O8+x (Tc 80K)
_cod_database_code 1008448
_database_code_amcsd 0016353
3.8415 3.8707 27.240 90 90 90 Ammm
atom  x  y     z  occ
Y1   .5 .5     0
Ba1  .5 .5 .1356
Cu1   0  0 .2127
Cu2   0  0 .0614
O1    0  0 .1454
O2   .5  0 .0524
O3    0 .5 .0528
O4    0 .5 .2187 .996
O5   .5  0  .254 .032
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Cu La2 O4
 
Chaillout C, Bordet P, Chenavas J, Cheong S, Fisk Z, Marezio M,
Morosin B, Schirber J
 
Materials Research Society Symposia Proceedings 169 (1990) 47-52
Structural aspects of the phase separation in La2CuO4.032
_cod_database_code 1008572
_database_code_amcsd 0016463
5.350 13.148 5.398 90 90 90 Cmca
atom    x      y      z  occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
La1     0 .36111  .0069       .0055  .0030  .0022      0      0  .0002
Cu1     0      0      0       .0042  .0050  .0001      0      0      0
O1      0 .18307 -.0356 .943  .0077  .0040  .0123      0      0 -.0014
O2    .25 .99303    .75 .993  .0055  .0094  .0023      0  .0007      0
O3   .030   .182   .100 .024
O4    .25   .243    .25 .016
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Cu La2 O4.024
 
Chaillout C, Bordet P, Chenavas J, Cheong S, Fisk Z, Marezio M,
Morosin B, Schirber J
 
Materials Research Society Symposia Proceedings 169 (1990) 47-52
Structural aspects of the phase separation in La2CuO4.032
_cod_database_code 1008573
_database_code_amcsd 0016464
5.350 13.148 5.398 90 90 90 Fmmm
atom    x      y    z  occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
La1     0 .36109    0       .0076  .0029  .0019      0      0      0
Cu1     0      0    0        .005  .0050   .001      0      0      0
O1      0  .1813    0  .80   .012   .001   .059      0      0      0
O2    .25      0  .75 .996   .008  .0191 .00001      0 -.0007      0
O3   -.01   .191 .046  .05
O4    .25    .25  .75 .016
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Ba2.1 Cu3 O6 Y0.9
 
Bordet P, Chaillout C, Capponi J, Chenavas J, Marezio M
 
Nature 327 (1987) 687-689
Crystal structure of Y0.9 Ba2.1 Cu3 O6, a compound related to
the high-Tc superconductor Y Ba2 Cu3 O7.
_cod_database_code 1008355
_database_code_amcsd 0016266
3.8715 3.8715 11.738 90 90 90 P4/mmm
atom  x  y     z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ba1  .5 .5 .1921      .0105  .0105  .0148      0      0      0
Y1   .5 .5    .5 .89  .0051  .0051  .0111      0      0      0
Ba2  .5 .5    .5 .11  .0051  .0051  .0111      0      0      0
Cu1   0  0     0      .0193  .0193   .017      0      0      0
Cu2   0  0 .3605      .0029  .0029  .0129      0      0      0
O1    0  0  .154       .018   .018   .010      0      0      0
O2   .5  0 .3794       .003   .009   .015      0      0      0
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Ba4 Cu7 O14.3 Y2
 
Bordet P, Chaillout C, Chenavas J, Hodeau J, Marezio M, Karpinski J, Kaldis E
 
Nature (London) 334 (1988) 596-598
Structure Determination of the new high-temperature Superconductor
Y Ba Cu O (2/4/7/14.30)
_cod_database_code 1008369
_database_code_amcsd 0016279
3.851 3.869 50.29 90 90 90 Ammm
atom  x  y      z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ba1  .5 .5 .04310      .0141  .0147  .0094      0      0      0
Ba2  .5 .5 .18797      .0059  .0063  .0070      0      0      0
Y1   .5 .5 .11545      .0003 -.0017  .0009      0      0      0
Cu1   0  0      0       .042   .047   .020      0      0      0
Cu2   0  0 .08293      .0033  .0053  .0084      0      0      0
Cu3   0  0 .14831      .0027  .0045  .0071      0      0      0
Cu4   0  0 .23012  .7   .011  .0048  .0015      0      0      0
Cu5   0  0 .23012  .3   .011  .0048  .0015      0      0      0
O1    0  0  .0353       .010    .09    .10      0      0      0
O2   .5  0  .0871
O3    0 .5  .0865
O4   .5  0  .1430
O5    0 .5  .1432
O6    0  0  .1937
O7    0 .5  .2328
O8    0 .5      0 .10
O9   .5  0      0 .20
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Cl Cu3 O8 Pb3 Sr3
 
Cava R, Bordet P, Capponi J, Chaillout C, Chenavas J, Fournier T,
Hewat E, Hodeau J, Levy J, Marezio M, Batlogg B, Rupp
 
Physica C 167 (1990) 67-74
Pb3Sr3Cu3O8+$-deltaCl: a new layered copper oxychloride
_cod_database_code 1008489
_database_code_amcsd 0016382
5.444 5.495 19.49 90 90 90 Cmmm
atom     x     y      z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Pb1      0     0 .40972      .0206  .0180  .0141      0      0      0
Sr1     .5     0 .27579      .0179  .0159  .0230      0      0      0
Pb2     .5     0 .09985  .5  .0119  .0116  .0273      0      0      0
Sr2     .5     0 .09985  .5  .0119  .0116  .0273      0      0      0
Cu1     .5     0     .5      .0191  .0183  .0067      0      0      0
Cu2      0     0 .18304      .0149  .0131  .0167      0      0      0
O1       0     0 .30277
O2   .4288 .0743  .4126 .25
O3     .25   .25 .17446
Cl1      0     0      0      .0250  .0306  .0777      0      0      0
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Ba Cu O5.05 Sr
 
Chaillout C, Huang Q, Cava R, Chenavas J, Santoro A, Bordet P,
Hodeau J, Krajewski J, Levy J, Marezio M, Peck W
 
Physica C 195 (1992) 335-344
Synthesis and crystal structure of BaSrCuO2+xCO3
_cod_database_code 1008567
_database_code_amcsd 0016458
5.5899 5.5899 7.7153 90 90 90 P4/mbm
atom     x     y     z   occ
Ba1      0     0 .2115    .5
Sr1      0     0 .2423    .5
Cu1     .5     0     0
C1      .5     0    .5
O1   .3434 .8434 .4553 .2625
O2   .2509 .7509 .0187    .5
O3   .4672 .9672 .3286   .25
O4   .4140 .9140 .3771   .25
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Ba2 Cu Hg0.88 O4.87 S0.18
 
Bordet P, Loureiro S, LeFloch S, Capponi J, Chaillout C, Chenavas J,
Tholence J, Antipov E, Radaelli P, Marezio M
 
Physica C 282 (1997) 65-68
High pressure synthesis and structure of the superconducting mercury
cuprates (Hg(1-x) M(x)) Ba2 Ca(n-1) Cu(n) O(2+2n+d) with M= C, S
_cod_database_code 1008817
_database_code_amcsd 0016687
3.8986 3.8986 9.2466 90 90 90 P4/mmm
atom    x     y     z  occ
Hg1     0     0     0  .88
Ba1    .5    .5 .2927
Cu1     0     0    .5
O1      0    .5    .5
O2      0     0 .2153
O3     .5    .5     0  .15
S1      0  .139     0 .045
O4   .330  .372     0 .045
O5      0 -.095  .138 .045
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Perovskite group
 
Meyer G, Gros Y, Bochu B, Collomb A, Chenavas J, Joubert J, Marezio M
 
Physica Status Solidi A48 (1978) 581-586
Synthesis, crystal structure, and Mossbauer study of a series of
perovskite-like compounds (A Cu3) (M, Fe)4 O12
_cod_database_code 1008788
_database_code_amcsd 0016660
7.436 7.436 7.436 90 90 90 Im3
atom     x     y   z occ
Nd1      0     0   0
Cu1      0    .5  .5
Ti1    .25   .25 .25 .75
Fe1    .25   .25 .25 .25
O1   .3017 .1778   0
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Ca Mn7 O12
 
Bochu B, Buevoz J, Chenavas J, Collomb A, Joubert J, Marezio M
 
Solid State Communications 36 (1980) 133-138
Bond lengths in (Ca Mn3) (Mn4) O12. A new Jahn-Teller distortion
of Mn^3+^ octahedra
_cod_database_code 1008267
_database_code_amcsd 0016189
10.4414 10.4414 6.3433 90 90 120 R-3
atom      x     y     z
Ca1       0     0     0
Mn1      .5     0     0
Mn2      .5     0    .5
Mn3       0     0    .5
O1    .2226 .2731 .0814
O2   .34219 .5221 .3410
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Total number of retrieved datasets: 22
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