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Ca(NO3)2(H2O)2 |
| |
Leclaire A, Mitschler A, Monier J |
 |
Acta Crystallographica B32 (1976) 1496-1499 |
|
Structure cristalline de l'hydrate Ca(NO3)2(H2O)2 alpha |
|
_cod_database_code 1001000 |
|
_database_code_amcsd 0009558 |
|
11.827 16.538 12.622 90. 90. 90. *Ccca |
|
0 .75 .75 |
|
atom x y z occ |
|
Ca1 .5 .51059 .25 |
|
Ca2 .27196 .25 .25 |
|
O1 .13048 .13275 .27624 |
|
O2 .02139 .12408 .41257 |
|
O3 .13076 .22657 .39081 |
|
N1 .0925 .15981 .36143 |
|
O4 .38141 .12587 .20372 |
|
O5 .27399 .12827 .06603 |
|
O6 .37308 .02063 .10241 |
|
N2 .34114 .0922 .12161 |
|
O7 .38771 .20739 .39638 |
|
O8 .36771 .03206 .3875 |
|
H1 .35937 .22708 .46641 .5 |
|
H2 .46675 .22846 .3911 .5 |
|
H3 .39037 .01243 .45937 .5 |
|
H4 .37458 .09228 .38943 .5 |
|
H5 .62616 .2253 .02908 .5 |
|
H6 .61546 .147 .10102 .5 |
|
H7 .61819 .02242 .03541 .5 |
|
H8 .71489 .02166 .12253 .5 |
|
|
| Download AMC data (View Text File)
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|
| |
|
Nitrocalcite |
 |
Leclaire A, Monier J C |
|
Acta Crystallographica B33 (1977) 1861-1866 |
|
Liaisons hydrogene dans les cristaux de Ca(NO3)2*4H2Oalpha |
|
Locality: synthetic |
|
_database_code_amcsd 0009594 |
|
6.2786 9.1551 14.8999 90 106.22 90 P2_1/c |
|
atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
|
Ca .32775 .41024 .36704 .01149 .00516 .00190 -.00027 .00139 -.00029 |
|
N1 .07165 .37196 .16956 .01428 .00680 .00242 -.00158 .00175 -.00057 |
|
O11 .05757 .48374 .21718 .02769 .00679 .00267 .00346 .00074 -.00073 |
|
O12 .18733 .26869 .21202 .02296 .00587 .00389 .00125 .00200 -.00024 |
|
O13 -.02525 .36516 .08576 .02321 .01469 .00220 -.00092 .00054 -.00148 |
|
N2 .48048 .73285 .40676 .01436 .00534 .00223 -.00070 .00197 .00031 |
|
O21 .54009 .62111 .45857 .02457 .00503 .00236 -.00094 .00084 .00061 |
|
O22 .54900 .85477 .43477 .02875 .00510 .00386 -.00325 .00196 .00003 |
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O23 .35068 .71221 .32758 .01701 .00897 .00226 .00007 .00088 .00016 |
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Ow1 .59973 .46279 .28249 .02180 .00768 .00393 -.00284 .00500 -.00141 |
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Ow2 .03795 .53620 .41525 .02289 .00698 .00359 .00322 .00476 .00131 |
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Ow3 .08003 .22224 .39698 .02946 .00722 .00310 -.00411 .00227 -.00032 |
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Ow4 .57447 .19691 .38527 .03691 .01251 .00548 .01060 .00856 .00337 |
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H11 .6203 .3934 .2512 3.19 |
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H12 .5884 .5413 .2489 5.44 |
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H21 .0252 .6130 .4109 3.62 |
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H22 .0745 .5148 .4697 .5 3.81 |
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H23 -.1226 .5006 .3575 .5 5.02 |
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H31 .0765 .1437 .3661 3.95 |
|
H32 .1411 .1855 .4506 3.42 |
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H41 .5789 .1456 .4220 4.28 |
|
H42 .7103 .2093 .3861 6.37 |
|
|
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|
| |
|
PbNb2O6 |
| |
Labbe P, Frey M, Raveau B, Monier J |
|
Acta Crystallographica B33 (1977) 2201-2212 |
|
Structure cristalline de la phase ferroelectrique du niobate de plomb PbNb2O6. |
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Deplacements des atomes metalliques et interpretation de la surstructure |
|
_cod_database_code 1001009 |
|
_database_code_amcsd 0009596 |
|
35.292 17.943 7.746 90 90 90 Bb2_1m |
|
atom x y z occ |
|
Nb1 .1249 .4997 .25 |
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Nb2 .1252 -.0005 .25 |
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Nb3 .0353 .6100 .25 |
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Nb4 .2149 .6106 .25 |
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Nb5 .0338 .3940 .25 |
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Nb6 .2160 .3949 .25 |
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Nb7 .0716 .1792 .25 |
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Nb8 .1778 .1865 .25 |
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Nb9 .0698 .8219 .25 |
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Nb10 .1804 .8212 .25 |
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Pb1 .0385 .0235 0 |
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Pb2 .0395 .0297 .5 |
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Pb3 .2095 .0335 0 |
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Pb4 .2128 .0182 .5 |
|
Pb5 .1274 .6999 0 |
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Pb6 .1303 .6902 .5 |
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Pb7 .1301 .3449 .5 |
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Pb8 .1173 .3438 0 |
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Pb9 .0017 .2482 0 .5 |
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Pb10 .2477 .2486 0 .5 |
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Pb11 .0010 .2497 .5 .5 |
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Pb12 .2481 .2489 .5 .5 |
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O1 .1128 .4837 0 |
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O2 .3672 -.0095 0 |
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O3 .1421 -.0071 0 |
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O4 .3870 .4945 0 |
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O5 .4607 .1001 .5 |
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O6 .4751 .1039 0 |
|
O7 .2762 .0964 .5 |
|
O8 .2912 .1121 0 |
|
O9 .0410 .3837 0 |
|
O10 .0288 .4062 .5 |
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O11 .2264 .3851 0 |
|
O12 .2038 .3734 .5 |
|
O13 .0736 .2064 0 |
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O14 .0660 .1515 .5 |
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O15 .1749 .1677 0 |
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O16 .1854 .1777 .5 |
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O17 .4276 .2978 .5 |
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O18 .4269 .3122 0 |
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O19 .3304 .3135 .5 |
|
O20 .3193 .2863 0 |
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O21 .4113 .0708 .2174 |
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O22 .3389 .0753 .2707 |
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O23 .4463 .2128 .2089 |
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O24 .3042 .2129 .2740 |
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O25 .0139 .4963 .2193 |
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O26 .2347 .4911 .2690 |
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O27 .0172 .1299 .2336 |
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O28 .2318 .1403 .2055 |
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O29 .0856 .0702 .2312 |
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O30 .1619 .0726 .2848 |
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O31 .1268 .2127 .2805 |
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O32 .377 .2742 .2426 |
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O33 .4110 .4187 .2839 |
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O34 .3401 .4255 .2050 |
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O35 .4836 .3492 .2739 |
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O36 .2703 .3430 .2745 |
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O37 .0509 .2695 .2979 |
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O38 .2000 .2816 .2504 |
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O39 .0851 .4048 .2808 |
|
O40 .1612 .4113 .2207 |
|
|
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|
| |
|
O3 Rb0.28 W |
| |
Labbe P, Goreaud M, Raveau B, Monier J |
|
Acta Crystallographica B34 (1978) 1433-1438 |
|
Etude comparative des structures Mx WO3 de type bronze hexagonal. |
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I. Analyse structurale des bronzes de composition M0.30WO3. |
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Stereochimie des elements M=Rb,Tl et In |
|
_cod_database_code 1001020 |
|
_database_code_amcsd 0009639 |
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7.3875 7.3875 7.5589 90 90 120 P6_3/mcm |
|
atom x y z occ |
|
W1 0 .48053 .25 |
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O1 .2149 .4224 .25 |
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O2 0 .4769 .0009 .5 |
|
Rb1 0 0 0 .85 |
|
|
| Download AMC data (View Text File)
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|
| |
|
O3 Tl0.3 W |
| |
Labbe P, Goreaud M, Raveau B, Monier J |
|
Acta Crystallographica B34 (1978) 1433-1438 |
|
Etude comparative des structures Mx WO3 de type bronze hexagonal. |
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I. Analyse structurale des bronzes de composition M0.30 W O3 . |
|
Stereochimie des elements M=Rb, Tl et In |
|
_cod_database_code 1001021 |
|
_database_code_amcsd 0009640 |
|
7.3810 7.3810 7.5091 90 90 120 P6_3/mcm |
|
atom x y z occ |
|
W1 0 .47744 .25 |
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O1 .2118 .4200 .25 |
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O2 0 .4635 -.0020 .5 |
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Tl1 0 0 .0307 .45 |
|
|
| Download AMC data (View Text File)
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|
| |
|
In0.3 O3 W |
| |
Labbe P, Goreaud M, Raveau B, Monier J |
|
Acta Crystallographica B34 (1978) 1433-1438 |
|
Etude comparative des structures Mx W O3 de type bronze hexagonal. I. |
|
Analyse structurale des bronzes de composition M0.3 W O3 . Stereochimie |
|
des elements M=Rb, Tl et In |
|
_cod_database_code 1001836 |
|
_database_code_amcsd 0009641 |
|
7.3750 7.3750 7.5009 90 90 120 P6_3/mcm |
|
atom x y z occ |
|
W1 0 .48154 .25 |
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O1 .2139 .4214 .2186 .5 |
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O2 0 .4673 -.0012 .5 |
|
In1 0 0 .0606 .18 |
|
In2 0 .0664 0 .09 |
|
|
| Download AMC data (View Text File)
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|
| |
|
In0.17 O3 W |
| |
Labbe P, Goreaud M, Raveau B, Monier J |
|
Acta Crystallographica B35 (1979) 1557-1564 |
|
Etude comparative des structures Mx W O3 de type bronze hexagonal. |
|
II. Evolution structurale dans la serie des bronzes Inx W O3 |
|
(x equals a number between 0.12 and 0.33) |
|
_cod_database_code 1001039 |
|
_database_code_amcsd 0009675 |
|
7.3762 7.3762 7.4983 90 90 120 P6_3/mcm |
|
atom x y z occ |
|
W1 0 .47681 .25 |
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O1 .2154 .4230 .2241 .5 |
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O2 0 .4726 .0012 .5 |
|
In1 0 0 .0701 .136 |
|
In2 0 .0596 0 .040 |
|
|
| Download AMC data (View Text File)
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|
| |
|
In0.15 O3 W |
| |
Labbe P, Goreaud M, Raveau B, Monier J |
|
Acta Crystallographica B35 (1979) 1557-1564 |
|
Etude comparative des structures Mx W O3 de type bronze hexagonal. |
|
II. Evolution structurale dans la serie des bronzes Inx W O3 |
|
(x equals a number between 0.12 and 0.33) |
|
_cod_database_code 1001040 |
|
_database_code_amcsd 0009676 |
|
7.3824 7.3824 7.5082 90 90 120 P6_3/mcm |
|
atom x y z occ |
|
W1 0 .47705 .25 |
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O1 .2139 .4215 .2251 .5 |
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O2 0 .4709 -.0023 .5 |
|
In1 0 0 .0722 .103 |
|
In2 0 .0508 0 .039 |
|
|
| Download AMC data (View Text File)
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|
| |
|
In0.18 O3 W |
| |
Labbe P, Goreaud M, Raveau B, Monier J |
|
Acta Crystallographica B35 (1979) 1557-1564 |
|
Etude comparative des structures Mx W O3 de type bronze hexagonal. |
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II. Evolution structurale dans la serie des bronzes Inx W O3 |
|
(x equals a number between 0.12 and 0.33) |
|
_cod_database_code 1001041 |
|
_database_code_amcsd 0009677 |
|
7.3888 7.3888 7.5007 90 90 120 P6_3/mcm |
|
atom x y z occ |
|
W1 0 .47682 .25 |
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O1 .215 .4229 .2207 .5 |
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O2 0 .4709 -.0009 .5 |
|
In1 0 0 .0553 .155 |
|
In2 0 .0605 0 .048 |
|
|
| Download AMC data (View Text File)
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|
| |
|
In0.21 O3 W |
| |
Labbe P, Goreaud M, Raveau B, Monier J |
|
Acta Crystallographica B35 (1979) 1557-1564 |
|
Etude comparative des structures Mx W O3 de type bronze hexagonal. |
|
II. Evolution structurale dans la serie des bronzes Inx W O3 |
|
(x equals a number between 0.12 and 0.33) |
|
_cod_database_code 1001042 |
|
_database_code_amcsd 0009678 |
|
7.3883 7.3883 7.5065 90 90 120 P6_3/mcm |
|
atom x y z occ |
|
W1 0 .47791 .25 |
|
O1 .2134 .4230 .2261 .5 |
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O2 0 .4702 -.0003 .5 |
|
In1 0 0 .0743 .177 |
|
In2 0 .0547 0 .049 |
|
|
| Download AMC data (View Text File)
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|
| |
|
In0.24 O3 W |
| |
Labbe P, Goreaud M, Raveau B, Monier J |
|
Acta Crystallographica B35 (1979) 1557-1564 |
|
Etude comparative des structures Mx W O3 de type bronze hexagonal. |
|
II. Evolution structurale dans la serie des bronzes Inx W O3 |
|
(x equals a number between 0.12 and 0.33) |
|
_cod_database_code 1001043 |
|
_database_code_amcsd 0009679 |
|
7.3837 7.3837 7.5012 90 90 120 P6_3/mcm |
|
atom x y z occ |
|
W1 0 .47850 .25 |
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O1 .2112 .4170 .2261 .5 |
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O2 0 .4629 -.0031 .5 |
|
In1 0 0 .0656 .180 |
|
In2 0 .0621 0 .064 |
|
|
| Download AMC data (View Text File)
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|
| |
|
In0.28 O3 W |
| |
Labbe P, Goreaud M, Raveau B, Monier J |
|
Acta Crystallographica B35 (1979) 1557-1564 |
|
Etude comparative des structures Mx W O3 de type bronze hexagonal. |
|
II. Evolution structurale dans la serie des bronzes Inx W O3 |
|
(x equals a number between 0.12 and 0.33) |
|
_cod_database_code 1001044 |
|
_database_code_amcsd 0009680 |
|
7.3673 7.3673 7.5020 90 90 120 P6_3/mcm |
|
atom x y z occ |
|
W1 0 .48098 .25 |
|
O1 .2109 .4213 .2224 .5 |
|
O2 0 .4646 -.0016 .5 |
|
In1 0 0 .0779 .188 |
|
In2 0 .0667 0 .078 |
|
|
| Download AMC data (View Text File)
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|
| |
|
In0.3 O3 W |
| |
Raveau B, Monier J |
|
Acta Crystallographica B35 (1979) 1557-1564 |
|
Etude comparative des structures Mx W O3 de type bronze hexagonal. |
|
II. Evolution structurale dans la serie des bronzes Inx W O3 |
|
(x equals a number between 0.12 and 0.33) |
|
_cod_database_code 1001045 |
|
_database_code_amcsd 0009681 |
|
7.3750 7.3750 7.5009 90 90 120 P6_3/mcm |
|
atom x y z occ |
|
W1 0 .48154 .25 |
|
O1 .2139 .4214 .2186 .5 |
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O2 0 .4673 -.0012 .5 |
|
In1 0 0 .0606 .178 |
|
In2 0 .0664 0 .093 |
|
|
| Download AMC data (View Text File)
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|
| |
|
In0.31 O3 W |
| |
Labbe P, Goreaud M, Raveau B, Monier J |
|
Acta Crystallographica B35 (1979) 1557-1564 |
|
Etude comparative des structures Mx W O3 de type bronze hexagonal. |
|
II. Evolution structurale dans la serie des bronzes Inx W O3 |
|
(x equals a number between 0.12 and 0.33) |
|
_cod_database_code 1001046 |
|
_database_code_amcsd 0009682 |
|
7.3716 7.3716 7.5038 90 90 120 P6_3/mcm |
|
atom x y z occ |
|
W1 0 .48451 .25 |
|
O1 .2101 .4192 .2192 .5 |
|
O2 0 .4547 -.0061 .5 |
|
In1 0 .0743 0 .156 |
|
|
| Download AMC data (View Text File)
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|
| |
|
Tachyhydrite |
|
Leclaire A, Borel M, Monier J |
|
Acta Crystallographica B36 (1980) 2734-2735 |
|
Structure de la tachydrite |
|
_cod_database_code 1001774 |
|
_database_code_amcsd 0009719 |
|
8.215 8.215 8.215 76.04 76.04 76.04 R-3 |
|
atom x y z |
|
Ca1 0 0 0 |
|
Cl1 .27068 .16138 -.15443 |
|
Mg1 .32405 .32405 .32405 |
|
O1 -.48186 .20142 .45471 |
|
O2 .44369 .18449 .13688 |
|
H1 .504 .155 .541 |
|
H2 -.386 .193 .401 |
|
H3 .388 .172 .0061 |
|
H4 .525 .104 .137 |
|
|
| Download AMC data (View Text File)
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|
| |
|
CaCl2*4H2O |
| |
Leclaire A, Borel M, Monier J |
|
Acta Crystallographica B36 (1980) 2757-2759 |
|
La Forme gamma du Dichlorure de Calcium Tetrahydrate |
|
_cod_database_code 1001110 |
|
_database_code_amcsd 0009723 |
|
6.1387 7.6669 8.9014 90 111.00 90 P2_1/c |
|
atom x y z |
|
Ca1 0 0 0 |
|
Cl1 .29901 .27899 .07381 |
|
O1 .31106 -.19653 .07661 |
|
O2 .00429 -.00152 .26223 |
|
H1 .413 .218 .170 |
|
H2 .407 -.220 .014 |
|
H3 .096 .057 .334 |
|
H4 -.103 -.037 .302 |
|
|
| Download AMC data (View Text File)
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|
| |
|
Mo3 O25 P5.8 Rb Si2 |
| |
Leclaire A, Monier J, Raveau B |
|
Acta Crystallographica B40 (1984) 180-185 |
|
A molybdosilicophosphate with an intersecting - tunnel structure, which |
|
exhibits ion - exchange properties, a Mo3 P5.8 Si2 O25 (A = Rb, Tl) |
|
_cod_database_code 1001852 |
|
_database_code_amcsd 0009803 |
|
8.2905 8.2905 17.4390 90 90 120 P-31c |
|
atom x y z occ |
|
Mo1 1/3 -.3333 .02239 |
|
Mo2 -.3333 1/3 .25 |
|
Rb1 1/3 -.3333 .25 |
|
P1 .37854 .32971 .11067 .97 |
|
Si1 0 0 .09078 |
|
O1 .11371 -.40782 .09504 |
|
O2 -.18867 .24728 .45370 |
|
O3 .46868 .33401 .18721 |
|
O4 0 0 0 |
|
O5 .03300 -.16308 .12389 |
|
|
| Download AMC data (View Text File)
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|
| |
|
Mo3 O25 P5.8 Si2 Tl |
| |
Leclaire A, Monier J, Raveau B |
|
Acta Crystallographica B40 (1984) 180-185 |
|
A molybdosilicophosphate with an intersecting - tunnel structure, which |
|
exhibits ion - exchange properties, a Mo3 P5.8 Si2 O25 (A = Rb, Tl) |
|
_cod_database_code 1001853 |
|
_database_code_amcsd 0009804 |
|
8.2832 8.2832 17.4343 90 90 120 P-31c |
|
atom x y z occ |
|
Mo1 1/3 -.3333 .02220 |
|
Mo2 -.3333 1/3 .25 |
|
Tl1 1/3 -.3333 .25 |
|
P1 .37818 .32978 .11045 .97 |
|
Si1 0 0 .09101 |
|
O1 .11354 -.40731 .09473 |
|
O2 -.19013 .24785 .45347 |
|
O3 .46868 .33401 .18721 |
|
O4 0 0 0 |
|
O5 .03358 -.16436 .12344 |
|
|
| Download AMC data (View Text File)
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|
| |
|
Letovicite |
|
Leclaire A, Ledesert M, Monier J, Daoud A, Damak M |
|
Acta Crystallographica B41 (1985) 209-213 |
|
Structure du disulfate acide de triammonium. Une redetermination. |
|
Relations des chaines de liaisons hydrogene avec la morphologie et la |
|
conductivite eletrique |
|
_cod_database_code 1001784 |
|
_database_code_amcsd 0009806 |
|
15.435 5.865 10.1696 90 101.829 90 C2/c |
|
atom x y z occ |
|
S1 .11418 .21828 .46135 |
|
N1 .5 .23039 .25 |
|
N2 .19893 .27573 .15266 |
|
O1 .01415 .18463 .44256 |
|
O2 .15024 .22318 .60589 |
|
O3 .12909 .43451 .39838 |
|
O4 .14906 .02625 .39784 |
|
H1 -.001 .047 .479 .5 |
|
H2 .476 .150 .191 |
|
H3 .461 .304 .276 |
|
H4 .186 .284 .228 |
|
H5 .193 .153 .113 |
|
H6 .257 .31 .164 |
|
H7 .175 .389 .112 |
|
|
| Download AMC data (View Text File)
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|
| |
|
Cs Mo3 O25 P5.8 Si2 |
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Leclaire A, Monier J, Raveau B |
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Acta Crystallographica C41 (1985) 1719-1720 |
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Structure of Cs Mo3 P5.8 Si2 O25 |
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_cod_database_code 1001334 |
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_database_code_amcsd 0010018 |
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8.2642 8.2642 17.559 90 90 120 P-31c |
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atom x y z occ |
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Mo1 1/3 -.3333 .02137 |
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Mo2 -.3333 1/3 .25 |
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Cs1 1/3 -.3333 .25 |
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P1 .37931 .32974 .11024 .967 |
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Si1 0 0 .09030 |
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O1 .11095 -.41158 .09285 |
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O2 -.19291 .24313 .45308 |
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O3 .46617 .33466 .18691 |
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O4 0 0 0 |
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O5 .03544 -.16229 .12292 |
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Nitrocalcite |
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Leclaire A, Monier J |
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Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences 271 (1970) 1555-1557 |
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Structure cristalline du nitrate de calcium tetrahydrate |
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_cod_database_code 1001743 |
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_database_code_amcsd 0012286 |
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6.268 9.116 14.83 90 106.50 90 P2_1/c |
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atom x y z |
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Ca1 .3277 .4102 .3670 |
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N1 .0726 .3716 .1684 |
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N2 .4800 .7334 .4053 |
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O1 .0601 .4844 .2171 |
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O2 .1897 .2686 .2121 |
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O3 -.0237 .3655 .0846 |
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O4 .5418 .6210 .4585 |
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O5 .5507 .8544 .4342 |
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O6 .3509 .7117 .3269 |
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O7 .6005 .4634 .2813 |
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O8 .0365 .5368 .4161 |
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O9 .0808 .2205 .3984 |
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O10 .5788 .1966 .3859 |
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Tl2W4O13 |
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Goreaud M, Labbe P, Monier J, Raveau B |
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Journal of Solid State Chemistry 30 (1979) 311-319 |
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The thallium tungstate Tl2W4O13 : A tunnel structure related to |
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the hexagonal tungsten bronze |
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_cod_database_code 1001080 |
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_database_code_amcsd 0013371 |
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7.327 37.864 3.840 90 90 90 Pmab |
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atom x y z occ |
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Tl1 .25 .00440 .0586 |
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W1 .25 .16574 .3845 |
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Tl2 .2155 .33484 -.0249 .5 |
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W2 .5059 .08219 .5095 |
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W3 .5 .25 .5248 |
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O1 .25 .0711 .4261 |
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O2 .0547 .1328 .5191 .5 |
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O3 .0730 .1318 .3691 .5 |
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O4 -.0508 .0374 .5137 .5 |
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O5 -.0611 .0367 .3682 .5 |
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O6 .0760 .2031 .5360 .5 |
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O7 .0740 .2047 .3733 .5 |
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O8 .25 .2655 .4277 |
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O9 .25 .3983 .4516 |
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O10 .1933 .1694 -.0806 .5 |
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O11 .4889 .0953 -.0157 .5 |
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O12 .5096 .0793 -.0157 .5 |
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O13 .4883 .2414 -.0448 .5 |
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K4 Mo8 O52 P12 |
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Leclaire A, Monier J, Raveau B |
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Journal of Solid State Chemistry 48 (1983) 147-153 |
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K4 Mo8 P12 O52, A Tunnel Structure Characterized by an Unusual |
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Valence of Molybdenum |
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_cod_database_code 1001236 |
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_database_code_amcsd 0013506 |
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10.7433 14.0839 8.8519 90 126.42 90 C2/c |
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atom x y z |
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Mo1 .24451 .08184 .17016 |
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K1 .25 .25 .5 |
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P1 .44330 .20465 .06075 |
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P2 0 .01061 .25 |
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O1 .13420 .07401 .29269 |
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O2 .41202 .15738 .40193 |
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O3 .32876 .13034 .03349 |
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O4 .12483 .22548 .09672 |
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O5 .05233 .05186 -.08101 |
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O6 .32703 -.02462 .22922 |
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O7 .5 .26041 .25 |
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Mo2 O12 P3 Tl |
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Leclaire A, Monier J, Raveau B |
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Journal of Solid State Chemistry 59 (1985) 301-305 |
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Tl Mo2^IV^ P3 O12: A Molybdenophosphate with a Tunnel Structure |
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_cod_database_code 1001342 |
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_database_code_amcsd 0013555 |
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8.836 9.255 12.288 90 90 90 Pbcm |
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atom x y z |
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Mo1 .24728 .029870 .10109 |
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Tl1 -.18018 .16397 .25 |
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P1 -.0255 .25 0 |
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P2 .4084 .3602 .1296 |
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O1 .2147 .0175 .25 |
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O2 .1234 -.1507 .0703 |
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O3 .2986 .0495 -.0606 |
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O4 .3866 .1994 .1222 |
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O5 .4287 -.1052 .1153 |
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O6 .0666 .1624 .0803 |
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O7 .3564 .4099 .25 |
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Mo2 O12 P3 Tl |
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Leclaire A, Monier J, Raveau B |
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Journal of Solid State Chemistry 59 (1985) 301-305 |
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TlMo2P3O12: A Molybdenophosphate with a Tunnel Structure |
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_cod_database_code 1001343 |
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_database_code_amcsd 0013556 |
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8.836 9.255 12.288 90 90 90 Pbcm |
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atom x y z |
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Mo1 .24728 .029870 .10109 |
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Tl1 -.18018 .16397 .25 |
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P1 -.0255 .25 0 |
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P2 .4084 .3602 .1296 |
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O1 .2147 .0175 .25 |
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O2 .1234 -.1507 .0703 |
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O3 .2986 .0495 -.0606 |
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O4 .3866 .1994 .1222 |
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O5 .4287 -.1052 .1153 |
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O6 .0666 .1624 .0803 |
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O7 .3564 .4099 .25 |
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| Download AMC data (View Text File)
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