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CsSb2PO8 |
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Crosnier M, Guyomard D, Verbaere A, Piffard Y |
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European Journal of Solid State and Inorganic Chemistry 26 (1989) 529-538 |
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Preparation and crystal structure of CsSb2PO8 |
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_cod_database_code 1000281 |
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_database_code_amcsd 0012529 |
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18.165 7.154 13.677 90 120.42 90 C2/m |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Cs1 .13606 0 .41426 .0258 .0130 .0170 0 .0097 0 |
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Cs2 .88973 0 .07220 .0421 .0148 .0200 0 .0155 0 |
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Sb1 .29432 .24897 .26932 .00465 .0046 .00329 .00050 .00209 .00033 |
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Sb2 .54917 0 .76370 .0034 .0060 .00219 0 .00137 0 |
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Sb3 .62668 0 .26998 .0038 .0068 .00334 0 .00206 0 |
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P1 .6587 0 .0621 .0056 .0078 .0015 0 .0007 0 |
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P2 .60733 0 .4959 .0051 .0077 .0025 0 .0017 0 |
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O1 .3816 .2069 .2300 .0080 .009 .0121 .002 .0070 .0002 |
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O2 .5129 0 .4073 .007 .016 .004 0 .0041 0 |
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O3 .5964 0 .1065 .009 .015 .005 0 .0033 0 |
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O4 .2484 0 .2261 .010 .005 .012 0 .004 0 |
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O5 .7156 .1758 .1043 .012 .009 .0065 -.003 .0043 -.001 |
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O6 .8388 0 .3096 .007 .006 .010 0 .004 0 |
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O7 .6623 0 .4395 .007 .021 .005 0 .0027 0 |
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O8 .7063 .2034 .3074 .0087 .011 .0104 -.003 .0067 -.003 |
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O9 .5349 .1789 .2402 .0084 .008 .0104 .000 .0061 .001 |
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O10 .3727 .1768 .4319 .011 .005 .0063 .001 .0030 .016 |
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O11 .3892 0 .0647 .011 .024 .004 0 .001 0 |
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Cs4(NbO)2(Si8O21) |
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Crosnier M, Guyomard D, Verbaere A, Piffard Y |
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European Journal of Solid State and Inorganic Chemistry 27 (1990) 435-442 |
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Synthesis and structure of a novel polysilicate |
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Cs4(NbO)2(Si8O21) |
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_cod_database_code 1000287 |
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_database_code_amcsd 0012530 |
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7.016 7.840 11.066 77.16 89.95 72.02 P-1 |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Cs1 .2095 .2096 .01373 .0140 .0225 .0147 -.0047 .0001 .0028 |
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Cs2 .1750 .2818 .36388 .0162 .0230 .0164 -.0066 .0011 -.0042 |
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Nb1 .7053 .2591 .18545 .0068 .0065 .0066 -.0027 .0010 -.0014 |
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Si1 .6488 .2962 .5012 .008 .007 .008 -.0017 .0008 -.0026 |
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Si2 .4339 .1404 .7125 .005 .011 .007 -.0029 .0004 -.0015 |
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Si3 .6605 .3301 .8693 .007 .011 .008 -.0029 .0018 -.0032 |
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Si4 .9945 .1883 .7047 .006 .008 .008 -.0009 .0004 -.0010 |
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O1 .5 .5 .5 |
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O2 .700 .219 .0099 |
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O3 .862 .265 .5714 |
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O4 .545 .153 .5832 |
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O5 .872 .3003 .8011 |
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O6 .194 .253 .6769 |
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O7 .952 .030 .2415 |
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O8 .562 .550 .8512 |
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O9 .146 .597 .8478 |
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O10 .533 .067 .2195 |
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O11 .482 .75 .2020 |
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O12 .317 .739 .6341 |
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K O5 Sb Si |
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Crosnier M, Guyomard D, Verbaere A, Piffard Y |
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European Journal of Solid State and Inorganic Chemistry 27 (1990) 845-854 |
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KSbOSiO4: a new isomorphous derivative of KTiOPO4 |
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_cod_database_code 1000298 |
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_database_code_amcsd 0012534 |
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13.005 6.4748 10.614 90 90 90 Pna2_1 |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Sb1 .38119 .5002 0 .0057 .0069 .0043 .0005 .0007 .0008 |
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Sb2 .24768 .2526 .2488 .0057 .0074 .0044 -.0004 .0003 -.0002 |
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Si1 .4998 .3271 .2488 .0060 .0086 .0063 -.002 -.0001 -.002 |
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Si2 .1815 .5039 .4994 .0081 .0060 .0062 .000 .005 -.0001 |
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K1 .3816 .7766 .3107 .024 .015 .032 .0064 .0068 .0049 |
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K2 .1073 .6962 .0656 .0138 .024 .036 .0060 .0001 .003 |
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O1 .4846 .491 .1344 |
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O2 .5082 .4661 .3765 |
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O3 .3966 .1834 .2677 |
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O4 .5993 .194 .2318 |
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O5 .1112 .303 .5314 |
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O6 .1077 .6979 .4723 |
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O7 .2558 .5380 .6188 |
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O8 .2626 .452 .3849 |
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O9 .2229 .980 .6322 |
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O10 .2286 .0390 .3777 |
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Bi0.5 O7 P2 Ta0.5 |
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Oyetola S, Verbaere A, Guyomard D, Crosnier M, Piffard Y, Tournoux M |
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European Journal of Solid State and Inorganic Chemistry 28 (1991) 23-36 |
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New ZrP2O7-like diphosphates of either mixed |
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(M^III^1/2M'^V^1/2) cations (M=Sb,Bi,Nd,Eu;M'=Sb, Nb,Ta) or M'^V^ |
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cations (M'=Ta,Nb):synthesis and structure |
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_cod_database_code 1000327 |
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_database_code_amcsd 0012540 |
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8.253 8.253 8.253 90 90 90 Pa3 |
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atom x y z occ |
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Bi1 0 0 0 .5 |
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Ta1 0 0 0 .5 |
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P1 .3970 .3970 .3970 |
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O1 .231 .431 .448 |
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O2 .5 .5 .5 |
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O7 P1.901 Ta0.899 |
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Oyetola S, Verbaere A, Guyomard D, Crosnier M, Piffard Y, Tournoux M |
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European Journal of Solid State and Inorganic Chemistry 28 (1991) 23-36 |
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New ZrP2O7-like diphosphates of either mixed |
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(M^III^1/2M'^V^1/2) cations (M=Sb,Bi,Nd,Eu;M'=Sb, Nb,Ta) or M'^V^ |
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cations (M'=Ta,Nb):synthesis and structure |
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_cod_database_code 1000328 |
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_database_code_amcsd 0012541 |
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8.109 8.109 8.109 90 90 90 Pa3 |
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atom x y z occ |
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Ta1 0 0 0 .899 |
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P1 .3925 .3925 .3925 .951 |
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O1 .4076 .4368 .2117 |
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O2 .5 .5 .5 |
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Cs8 Nb10 O41 Si6 |
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Crosnier M, Pagnoux C, Guyomard D, Verbaere A, Piffard Y, Tournoux M |
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European Journal of Solid State and Inorganic Chemistry 28 (1991) 971-981 |
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The crystal structure of a novel cyclotrisilicate: Cs8Nb10O23(Si3O9)2. |
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Its relationship with the pyrochlore and benitoite types |
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_cod_database_code 1000469 |
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_database_code_amcsd 0012545 |
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7.342 7.342 22.16599 90 90 120 P6_3/mmc |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Cs1 1/3 2/3 .15558 .0311 .0311 .0276 .0156 0 0 |
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Cs2 0 0 .09183 .0345 .0345 .0233 .0173 0 0 |
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Nb1 .5 0 0 .0264 .0214 .0235 .0107 -.0003 -.0006 |
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Nb2 1/3 2/3 .63573 .0176 .0176 .0158 .0088 0 0 |
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Si1 .8623 .7246 .25 .0011 .0004 .0017 .0002 0 0 |
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O1 .117 .234 .25 .0010 .0007 .0056 .0004 0 0 |
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O2 .2090 .4180 .4816 .917 .0032 .0034 .0031 .0017 -.0003 -.0006 |
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O3 .5457 .0914 .0863 .0043 .0016 .0019 .0008 -.0002 -.0004 |
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O4 .2057 .4114 .6898 .0048 .0017 .0018 .0009 .0003 .0006 |
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K2 Nb2 O14 Si4 |
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Crosnier M, Guyomard D, Verbaere A, Piffard Y, Tournoux M |
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Journal of Solid State Chemistry 98 (1992) 128-132 |
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The potassium niobyl cyclotetrasilicate K2(NbO)2Si4O12 |
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_cod_database_code 1000339 |
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_database_code_amcsd 0013735 |
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8.7404 8.7404 8.136 90 90 90 P4bm |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Nb1 0 0 .2160 .0071 .0071 .0079 0 0 0 |
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Nb2 0 0 .7194 .0064 .0064 .0079 0 0 0 |
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K1 .3226 .8226 .9919 .0180 .0180 .0124 -.0034 .0005 .0005 |
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Si1 .1242 .6242 .3015 .0076 .0076 .0039 .0007 .0004 .0004 |
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Si2 .1240 .6240 .6938 .0071 .0071 .0036 -.0001 -.0003 -.0003 |
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O1 .4251 .2882 .2330 |
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O2 .4219 .2892 .7654 |
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O3 0 0 0 |
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O4 0 0 .5010 |
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O5 .1200 .6200 .4968 |
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O6 .5 0 .228 |
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O7 .5 0 .7628 |
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