American Mineralogist Crystal Structure Database

19 matching records for this search.

Tl2Mo2P2O11
 
Guesdon A, Borel M, Grandin A, Leclaire A, Raveau B
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-2701&volume=49&spage=1877
Acta Crystallographica C49 (1993) 1877-1879
Structure of Tl2Mo2P2O11
_cod_database_code 1001592
_database_code_amcsd 0010287
9.945 10.156 9.974 90 97.64 90 P2_1/c
atom     x     y     z occ
Mo1  .3448 .0853 .1325
Mo2  .0775 .3219 .1467
P1   .3962 .3755 .3154
P2   .1260 .0758 .3535
Tl1      0     0     0
Tl2  .7572 .1776 .2865
Tl3  .5273 .0798 .5077  .5
O1    .287 -.057  .061
O2    .427  .152 -.033
O3    .269  .054  .317
O4    .526  .001  .221
O5    .192  .192  .095
O6    .443  .258  .238
O7   -.073  .265  .066
O8   -.024  .480  .225
O9    .135  .449  .006
O10   .072  .216  .320
O11   .247  .408  .272
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Mo2 O11 P2 Rb2
 
Guesdon A, Leclaire A, Borel M, Grandin A, Raveau B
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-2701&volume=50&spage=1852
Acta Crystallographica C50 (1994) 1852-1854
An Mo^V^ monophosphate, Rb2Mo2P2O11
_cod_database_code 1001613
_database_code_amcsd 0010296
9.973 10.180 10.012 90 97.70 90 P2_1/c
atom      x     y     z occ
Mo1   .3458 .0854 .1344
Mo2   .0794 .3223 .1474
P1    .3968 .3743 .3171
P2    .1263 .0754 .3541
Rb1       0     0     0
Rb2   .7620 .1852 .2901
Rb3   .5132 .0685 .5069  .5
O1    .2846 -.058  .064
O2    .4286 .1493 -.029
O3    .2681  .053  .317
O4    .5255 -.004  .221
O5    .1952 .1957 .0958
O6    .4436  .255 .2434
O7    -.070  .262  .068
O8   -.0261  .478 .2232
O9    .1340 .4489 .0063
O10    .068  .216 .3227
O11   .2470 .4043 .2748
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Al3 Cs7 K2 Mo9 O59 P11
 
Guesdon A, Leclaire A, Borel M, Raveau B
 
Chemistry of Materials 7 (1995) 1873-1878
Significant structural disorganization in alkaline molybdenum(V)
aluminophosphates
_cod_database_code 1001863
_database_code_amcsd 0012206
16.952 16.952 11.833 90 90 120 P6_3/m
atom      x      y      z  occ
K1   .14585 .52661  .4524 .333
Cs1  .14585 .52661  .4524 .667
Cs2  .02728  .1981  .2632   .5
Mo1  .27303 .44149    .25
Mo2  .27964 .23429 .36063
P1    .4486  .4133    .25
P2    .3785  .1285  .4822
P3      2/3    1/3  .7135   .5
P4      1/3    2/3   .700   .5
Al1   .4871  .1557    .25
O1    .1615  .4079    .25
O2    .3193  .5756    .25
O3    .2548  .3115    .25
O4    .2869  .4478  .4209
O5    .4139  .4826    .25
O6    .1704  .1495  .3772
O7    .2720  .3037  .5025
O8    .3412  .1936  .4767
O9    .3192  .1776    .25
O10   .4147  .3543  .3554
O11   .5533  .4684    .25
O12   .4299  .1317  .3765
O13     2/3    1/3   .587   .5
O14   .3039  .5738    .75
O15     1/3    2/3   .573   .5
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Ag Mo3 O16 P3
 
Guesdon A, Borel M, Grandin A, Leclaire A, Raveau B
 
Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences 316 (1993) 477-482
Structure du monophosphate de molybdene a valence mixte
AgMo^V^2Mo^VI^P3O16
_cod_database_code 1001544
_database_code_amcsd 0012311
6.403 7.600 12.769 80.11 79.59 83.82 P-1
atom      x      y      z
Mo1  .20270 .21603 .54602
Mo2  .40997 .75723 .16430
Mo3  .06350 .21074 .13882
Ag1  .59455  .3295 .33336
P1    .5751  .1706  .0994
P2    .3062  .8576  .4200
P3    .0680  .4806  .3171
O1    .1887  .0540  .6519
O2    .8999  .2226  .5243
O3    .5148  .2605  .5301
O4    .3045  .0520  .4349
O5    .1346  .4276  .6242
O6    .2245  .4079  .3935
O7    .0884  .3181  .0125
O8   -.0106  .3270  .2715
O9    .7453  .2104  .1617
O10   .1276 -.0109  .1301
O11   .3608  .2450  .1585
O12   .6086  .6056  .1869
O13   .3773  .7299  .0155
O14   .1678  .6075  .2189
O15   .3455  .8557  .2993
O16   .5768  .9700  .1005
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Cs1.5 K0.425 Mo2 O11 P2
 
Guesdon A, Leclaire A, Borel M, Raveau B
 
European Journal of Solid State and Inorganic Chemistry 33 (1996) 385-396
Highly ordered distribution of the interpolated univalent cations in
monophosphates with the alpha-(K2 Mo2 O3 (P O4)2) structure
_cod_database_code 1001726
_database_code_amcsd 0012601
10.159 10.103 10.003 90 99.48 90 P2_1/c
atom     x     y     z occ
Mo1  .3395 .0772 .1254
Mo2  .0868 .3228 .1394
P1   .4026 .3620 .3213
P2   .1209 .0668 .3414
K1       0     0     0 .85
Cs1  .7522 .1974 .2625
Cs2  .5043 .0262 .5007  .5
O1    .276 -.056  .046
O2    .430  .161 -.025
O3    .253  .031  .296
O4    .513 -.024  .213
O5    .194  .192  .089
O6    .444  .234  .253
O7   -.057  .267  .051
O8   -.010  .476  .226
O9    .139  .453     0
O10   .074  .211  .311
O11   .256  .400  .266
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Cs K Mo2 O11 P2
 
Guesdon A, Leclaire A, Borel M, Raveau B
 
European Journal of Solid State and Inorganic Chemistry 33 (1996) 385-396
Highly ordered distribution of the interpolated univalent cations in
monophosphates with the alpha-(K2 Mo2 O3 (P O4)2) structure
_cod_database_code 1001727
_database_code_amcsd 0012602
10.121 10.154 9.820 90 100.59 90 P2_1/c
atom      x      y      z occ
Mo1  .34300 .07295 .13259
Mo2  .08681 .31723 .13985
P1    .4047  .3587  .3256
P2    .1244  .0604  .3484
K1        0      0      0
Cs1  .75072 .19316 .25759
K2    .5001  .0301  .4977  .5
O1    .2763 -.0612  .0448
O2    .4408  .1476 -.0145
O3    .2624  .0261  .3114
O4    .5137 -.0292  .2263
O5    .1998  .1895  .0872
O6    .4433  .2263  .2669
O7   -.0604  .2620  .0466
O8   -.0169  .4642  .2271
O9    .1400  .4540  .0066
O10   .0762  .2014  .3079
O11   .2576  .3917  .2779
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Cs0.74 K1.26 Mo2 O11 P2
 
Guesdon A, Leclaire A, Borel M, Raveau B
 
European Journal of Solid State and Inorganic Chemistry 33 (1996) 385-396
Highly ordered distribution of the interpolated univalent cations in
monophosphates with the alpha-(K2 Mo2 O3 (P O4)2) structure
_cod_database_code 1001728
_database_code_amcsd 0012603
10.080 10.146 9.830 90 100.25 90 P2_1/c
atom      x      y     z occ
Mo1   .3437  .0748 .1329
Mo2   .0847  .3174 .1405
P1    .4028  .3615 .3235
P2    .1259  .0620 .3497
K1    .7508  .1930 .2596 .26
Cs1   .7508  .1930 .2596 .74
K2        0      0     0
K3    .5006  .0395 .4993  .5
O1    .2789  -.063  .050
O2    .4396  .1491 -.017
O3    .2640  .0300  .313
O4    .5179 -.0223 .2259
O5    .1984   .190 .0897
O6    .4436  .2305 .2624
O7   -.0622   .262  .049
O8   -.0194  .4658  .226
O9    .1359  .4552  .007
O10   .0732  .2024 .3095
O11    .254  .3946  .277
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K0.88 Mo2 O11 P2 Rb1.12
 
Guesdon A, Leclaire A, Borel M, Raveau B
 
European Journal of Solid State and Inorganic Chemistry 33 (1996) 385-396
Highly ordered distribution of the interpolated univalent cations in
monophosphates with the alpha-(K2 Mo2 O3 (P O4)2) structure
_cod_database_code 1001729
_database_code_amcsd 0012604
9.961 10.134 9.884 90 99.16 90 P2_1/c
atom      x      y      z occ
Mo1  .34525 .08083 .13282
Mo2  .07868 .31845 .14284
P1    .3987  .3702  .3182
P2    .1265  .0682  .3517
K1        0      0      0
Rb1   .7559  .1883  .2728
K2    .5037  .0529  .5027 .38
Rb2   .5037  .0529  .5027 .12
O1    .2826 -.0612  .0589
O2    .4353  .1502 -.0237
O3    .2696  .0460  .3167
O4    .5253 -.0072  .2248
O5    .1948  .1896  .0911
O6    .4454  .2477  .2462
O7   -.0710  .2603  .0577
O8   -.0271  .4681  .2259
O9    .1347  .4526  .0065
O10   .0693  .2076  .3159
O11   .2477  .3990  .2770
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Cs(MoO)P2O7
 
Guesdon A, Borel M, Leclaire A, Grandin A, Raveau B
 
Journal of Solid State Chemistry 108 (1994) 46-50
A molybdenum (V) diphosphate closely related to the alpha-NaTiP2O7 structure:
Cs(MoO)P2O7
_cod_database_code 1001618
_database_code_amcsd 0013789
5.1340 11.707 12.063 90 91.77 90 P2_1/n
atom     x      y      z
Mo1  .2365 .04536 .18973
Cs1  .7688 .33667 .05123
P1   .7646  .1668  .3101
P2   .7781  .3972  .4185
O1    .238 -.0362  .3029
O2    .026  .1750  .2542
O3    .551  .1379  .2233
O4   -.097 -.0083  .1164
O5    .440 -.0717  .1000
O6    .247  .1455  .0339
O7    .763  .0989  .4119
O8    .699  .2986  .3341
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KMo3P2O14
 
Guesdon A, Borel M, Leclaire A, Grandin A, Raveau B
 
Journal of Solid State Chemistry 109 (1994) 145-151
A mixed-valent molybdenum monophosphate with a layer structure: KMo3P2O14
_cod_database_code 1001620
_database_code_amcsd 0013800
8.599 6.392 10.602 90 111.65 90 P2_1/m
atom      x     y      z
Mo1  .23363   .25 .00971
Mo2  .24876   .25 .32984
Mo3  .84014   .25 .38009
P1    .8530   .25  .0650
P2    .1120   .75  .2998
K1    .4841   .75  .2483
O1    .3904   .25 -.0467
O2    .0373   .25 -.1656
O3    .2170 .5597  .0265
O4    .3539   .25  .2049
O5    .0438   .25  .1169
O6    .4165   .25  .4731
O7    .0710   .25  .3876
O8    .2252 .5619  .3096
O9    .7219  .037  .3719
O10   .7896   .25  .1801
O11   .9544   .25  .5843
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Cs6 H2 Mo7 O38 P7
 
Guesdon A, Borel M, Leclaire A, Grandin A, Raveau B
 
Journal of Solid State Chemistry 111 (1994) 315-321
A mixed-valent molybdenum monophosphate with a "butterfly"-shaped
tunnel structure Cs6Mo7O9(PO4)7*H2O
_cod_database_code 1001603
_database_code_amcsd 0013814
10.084 21.297 17.491 90 90 90 Pnma
atom     x     y     z
Cs1  .4553 .0380 .6085
Cs2  .1872   .25 .5811
Cs3  .3713 .1342 .1737
Cs4  .2440   .25 .8323
Mo1  .0376 .1889 .0216
Mo2  .0763 .0425 .5152
Mo3  .1494 .9875 .3150
Mo4  .2625   .25 .3519
P1    .130 .0931 .6974
P2    .286 .0833 .9759
P3   .2993 .1030 .4006
P4    .080   .25 .1870
O1    .479  .179  .568
O2    .171   .25  .004
O3   -.064  .109  .058
O4    .193  .127  .014
O5    .895   .25  .062
O6    .098  .191  .139
O7   -.066  .105  .509
O8    .154  .083  .611
O9    .037  .006  .411
O10   .182  .108  .454
O11   .229 -.016  .515
O12   .123   .25  .403
O13   .176   .25  .251
O14   .279  .158  .344
O15   .437   .25  .280
O16   .091  .046  .262
O17   .018  .924  .282
O18   .273  .955  .240
O19   .301  .040  .360
O20   .236  .920  .392
O21   .162  .159  .720
O22   .438   .25  .727
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Mo4 O22 P4 Rb3
 
Borel M, Leclaire A, Guesdon A, Grandin A, Raveau B
 
Journal of Solid State Chemistry 112 (1994) 15-21
Mixed valent molybdenum monophosphates with an intersecting tunnel
structure: A3O2(MoO)4(PO4)4 (A=Rb, Tl)
_cod_database_code 1001610
_database_code_amcsd 0013821
14.222 14.223 19.22699 90 90 90 C222_1
atom      x      y      z
Rb1  .05358 .44118 .12649
Rb2   .2081      0     .5
Rb3  .44128 .44653 .37644
Rb4      .5  .2084    .25
Mo1  .19029 .32595 .31033
Mo2  .17406 .19026 .06031
Mo3  .42511 .18052 .06374
Mo4  .18057 .07492 .31366
P1    .0526  .2087  .4196
P2    .3451  .1996  .4100
P3    .3005  .3450  .1601
P4    .2917  .0530  .1696
O1    .1026  .3734  .2637
O2    .1783  .2008  .2870
O3    .1098  .2929  .3950
O4    .2959  .3436  .2403
O5    .2192  .4535  .3576
O6    .3027  .2869  .3773
O7    .1262  .1034  .0135
O8    .0479  .2190  .1073
O9    .2065  .1099  .1445
O10   .1558  .2954 -.0094
O11   .2990  .1780  .0366
O12   .2117  .3032  .1276
O13   .4685  .0966  .0127
O14   .4484  .2910  .0004
O15   .5509  .1967  .1142
O16   .3869  .0956  .1465
O17   .3896  .2944  .1376
O18   .0959  .0307  .2628
O19   .0935  .1133  .3967
O20   .1954 -.0499  .3632
O21   .2919  .0507  .2502
O22   .2945  .1105  .3876
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Cs9Mo9Al3P11O59
 
Guesdon A, Borel M, Leclaire A, Grandin A, Raveau B
 
Journal of Solid State Chemistry 114 (1995) 451-458
An aluminophosphate of molybdenum(V) with a tunnel structure: Cs9Mo9Al3P11O59
_cod_database_code 1001641
_database_code_amcsd 0013836
16.989 16.989 11.866 90 90 120 P6_3/m
atom      x      y      z occ
Cs1  .14693 .52752 .45383
Cs2  .02678 .19754  .2644  .5
Mo1  .27147 .44017    .25
Mo2  .27908 .23409 .36040
P1    .4469  .4138    .25
P2    .3778  .1280  .4817
P3      2/3    1/3  .7138  .5
P4      1/3    2/3  .7057  .5
Al1   .4873  .1551    .25
O1    .1607  .4063    .25
O2    .3169  .5747    .25
O3    .2534  .3114    .25
O4    .2857  .4460  .4189
O5    .4124  .4822    .25
O6    .1699  .1494  .3759
O7    .2713  .3025  .5014
O8    .3402  .1924  .4757
O9    .3193  .1793    .25
O10   .4130  .3543  .3554
O11   .5509  .4687    .25
O12   .4308  .1318  .3777
O13     2/3    1/3   .588  .5
O14   .3055  .5722    .75
O15     1/3    2/3   .579  .5
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K2Mo2O4P2O7
 
Guesdon A, Leclaire A, Borel M, Grandin A, Raveau B
 
Journal of Solid State Chemistry 114 (1995) 481-485
A molybdenum(V) diphosphate with a tunnel structure: beta-K2Mo2O4P2O7
_cod_database_code 1001642
_database_code_amcsd 0013837
9.314 8.8679 10.954 90 90 90 Pbcn
atom      x      y      z
K1    .2954 -.0097  .4123
Mo1  .07834 .23067 .15380
P1    .4302  .3233  .1273
O1    .0804  .4210  .1377
O2    .1262  .2022  .3234
O3    .0494  .2005 -.0345
O4    .3005  .2246  .1027
O5    .1080 -.0144  .1443
O6       .5   .259    .25
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Ba2 Bi0.22 Cu Hg0.78 O4.28
 
Pelloquin D, Maignan A, Guesdon A, Hardy V, Raveau B
 
Physica C 265 (1996) 5-12
Single crystal study of the "1201" superconductor Hg0.8Bi0.2Ba2CuO4+d
_cod_database_code 1001762
_database_code_amcsd 0015078
3.8800 3.8800 9.492 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)
Hg1    0   0     0 .78  .0167  .0167  .0074      0      0      0
Bi1    0   0     0 .22  .0167  .0167  .0074      0      0      0
Ba1   .5  .5 .2963       .076   .076  .0074      0      0      0
Cu1    0   0    .5      .0034  .0034   .007      0      0      0
O1    .5   0    .5       .007   .011  .0010      0      0      0
O2     0   0  .209       .027   .027   .006      0      0      0
O3   .38 .38     0 .07
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Cs Mo2 O10 P2
 
Guesdon A, Borel M, Leclaire A, Grandin A, Raveau B
 
Zeitschrift fur Anorganische und Allgemeine Chemie 619 (1993) 1841-1849
A series of Mixed-valent Molybdenum Monophosphates, Isotypic with
Leucophosphite Represented by CsMo2P2O10 and
K1.5Mo2P2O10.H2O
_cod_database_code 1001553
_database_code_amcsd 0015801
9.428 9.943 12.348 90 127.38 90 P2_1/c
atom       x      y      z occ
Mo1   .23548 .19384 .15500
Mo2  -.00706 .02639 .40116
Cs1   .67813 .18176 .02814  .9
Cs2    .6397  .2643  .0807  .1
P1     .1443  .3064  .3515
P2     .6212  .0013  .3356
O1     .0768  .0830  .1100
O2     .2780  .2551  .3278
O3     .2539  .1532  .0029
O4     .0550  .3490  .0514
O5     .4581  .0857  .2808
O6     .4270  .3560  .2090
O7     .0093  .1970  .3167
O8    -.0451 -.0709  .2401
O9     .2535 -.0106  .5055
O10   -.2698  .0609  .2889
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H2 K1.5 Mo2 O11 P2
 
Guesdon A, Borel M, Leclaire A, Grandin A, Raveau B
 
Zeitschrift fur Anorganische und Allgemeine Chemie 619 (1993) 1841-1849
A series of Mixed-valent Molybdenum Monophosphates, Isotypic with
Leucophosphite Represented by CsMo2P2O10 and
K1.5Mo2P2O10.H2O
_cod_database_code 1001554
_database_code_amcsd 0015802
9.721 9.805 12.329 90 128.73 90 P2_1/c
atom       x      y      z
Mo1   .24381 .19915 .16639
Mo2  -.01509 .03244 .39774
K1        .5      0      0
K2     .6834  .3472  .1538
P1     .1511  .3098  .3600
P2     .6278  .0124  .3415
O1     .1031  .0724  .1236
O2     .2825  .2555  .3406
O3     .2664  .1606  .0183
O4     .0622  .3501  .0589
O5     .4660  .0933  .2988
O6     .4280  .3685  .2172
O7     .0037  .2105  .3144
O8    -.0707 -.0582  .2225
O9     .2434 -.0076  .4961
O10   -.2797  .0837  .2902
O11    .7239  .3311  .5063
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KMo3P2O14
 
Borel M, Guesdon A, Leclaire A, Grandin A, Raveau B
 
Zeitschrift fur Anorganische und Allgemeine Chemie 620 (1994) 569-573
New mixed-valent molybdenum monophosphates with the KMo3P2O14 structure
_cod_database_code 1001598
_database_code_amcsd 0015808
8.174 6.392 10.550 90 111.66 90 P2_1/m
atom      x     y      z
Mo1  .24667   .25 .00951
Mo2  .26239   .25 .33002
Mo3  .83041   .25 .37756
P1    .8443   .25  .0618
P2    .1202   .75  .3002
Ag1  .49748   .75 .25652
O1    .4030   .25 -.0565
O2    .0356   .25  .8342
O3    .2297 .5602  .0300
O4    .3731   .25  .2039
O5    .0459   .25  .1155
O6    .4363   .25  .4770
O7    .0711   .25  .3862
O8    .2403 .5613  .3100
O9    .7066 .0337  .3683
O10   .7767   .25  .1769
O11   .9474   .25  .5827
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Mo3 O14 P2 Sr
 
Borel M, Guesdon A, Leclaire A, Grandin A, Raveau B
 
Zeitschrift fur Anorganische und Allgemeine Chemie 620 (1994) 569-573
New mixed-valent molybdenum monophosphates with the KMo3P2O14 structure
_cod_database_code 1001599
_database_code_amcsd 0015809
8.288 6.430 10.648 90 112.83 90 P2_1/m
atom     x    y     z
Mo1  .2494  .25 .0143
Mo2  .2620  .25 .3314
Mo3  .8359  .25 .3782
P1   .8442  .25 .0617
P2   .1186  .75 .2998
Sr1  .4843  .75 .2506
O1    .398  .25 -.060
O2    .038  .25  .834
O3    .237 .561  .034
O4    .374  .25  .204
O5    .041  .25  .114
O6    .427  .25  .478
O7    .062  .25  .388
O8    .238 .568  .306
O9    .715 .027  .360
O10   .775  .25  .172
O11   .935  .25  .577
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Total number of retrieved datasets: 19
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