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Chalconatronite |
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Mosset A, Bonnet J J, Galy J |
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Zeitschrift fur Kristallographie 148 (1978) 165-177 |
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Structure cristalline de la chalconatronite synthetique: Na2Cu(CO3)2*3H2O |
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Locality: synthetic |
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_database_code_amcsd 0010801 |
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9.696 6.101 13.779 90 91.83 90 P2_1/n |
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atom x y z Biso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Na1 .6645 .7633 .2014 .0224 .0165 .0217 -.0008 -.0020 .0023 |
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Na2 .6063 .5223 .4018 .0246 .0200 .0176 .0015 -.0009 .0004 |
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Cu .12300 .99013 .31960 .0138 .0150 .0154 -.0013 -.0045 .0039 |
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C1 -.0767 .7596 .3282 .0150 .0145 .0144 .0012 -.0030 -.0010 |
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C2 .3822 .8474 .3248 .0162 .0123 .0134 .0011 -.0020 .0011 |
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O1 .0327 .7380 .3864 .0181 .0240 .0191 -.0037 -.0098 .0082 |
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O2 -.1811 .6398 .3322 .0170 .0176 .0275 -.0045 -.0039 .0013 |
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O3 -.0647 .9177 .2664 .0183 .0160 .0169 -.0021 -.0057 .0049 |
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O4 .3132 .7210 .2655 .0166 .0239 .0275 .0014 -.0063 -.0142 |
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O5 .5122 .8465 .3320 .0138 .0196 .0258 -.0002 -.0041 -.0048 |
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O6 .3094 .9749 .3783 .0160 .0147 .0156 .0021 -.0039 -.0024 |
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O7 .0304 -.7316 .4183 .0330 .0239 .0182 -.0013 -.0045 .0039 |
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O8 .3201 .8455 .5794 .0328 .0206 .0192 -.0047 -.0042 .0023 |
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O9 .1306 .8973 .0687 .0313 .0234 .0228 .0067 -.0043 .0045 |
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H1 0 .24 .48 1.96 |
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H2 .02 .44 .42 1.96 |
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Cl Cu H6.9 N3 O0.45 S3 |
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Mosset A, Abboudi M, Galy J |
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Zeitschrift fur Kristallographie 164 (1983) 171-180 |
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Synthese, structure moleculaire et cristalline d'un rubeanate de |
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cuivre(I): Cu Cl (C2 N2 S2 H4)1.5 (H2 O)0.45 |
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_cod_database_code 1008176 |
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_database_code_amcsd 0016113 |
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14.258 22.686 13.503 90 90 90 *Ccca |
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0 .75 .75 |
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atom x y z occ |
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Cu1 .6326 .15749 .4944 |
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Cl1 .4968 .1092 .4293 |
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S1 .6201 .1708 .6594 |
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S2 .6561 .2414 .4069 |
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S3 .7514 .0933 .4701 |
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N1 .442 .169 .636 |
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N2 .620 .1743 .255 |
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N3 .631 .0102 .513 |
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C1 .511 .169 .695 |
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C2 .636 .2257 .288 |
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C3 .715 .0265 .490 |
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O1 .536 .512 .241 .225 |
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O2 .707 .473 .259 .225 |
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H1 .379 .167 .663 |
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H2 .448 .169 .566 |
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H3 .618 .14 .298 |
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H4 .609 .167 .185 |
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H5 .617 -.032 .53 |
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H6 .581 .04 .517 |
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Cl Cu H4 N2 S2 |
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Mosset A, Abboudi M, Galy J |
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Zeitschrift fur Kristallographie 164 (1983) 181-188 |
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Etude structurale, par diffraction des rayons X, du rubeanate de |
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cuivre(I): Cu Cl (C2 N2 S2 H4) |
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_cod_database_code 1008177 |
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_database_code_amcsd 0016114 |
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15.576 6.923 11.416 90 90 90 Pbca |
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atom x y z |
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Cu1 .1682 .117 .2438 |
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Cl1 .1613 .086 .0420 |
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S1 .2927 .252 .301 |
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S2 .5425 .165 .165 |
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N1 .356 .079 .115 |
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N2 .470 .163 .373 |
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C1 .372 .157 .220 |
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C2 .459 .159 .258 |
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H1 .405 .023 .067 |
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H2 .296 .073 .082 |
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H3 .42 .163 .428 |
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H4 .53 .16 .407 |
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As1.43 Te0.46 Zr |
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Mosset A, Jeannin Y |
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Journal of Solid State Chemistry 7 (1973) 124-131 |
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Etude cristallographique de l'arsenotellurure de zirconium quadratique |
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_cod_database_code 1008961 |
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_database_code_amcsd 0016826 |
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3.82 3.82 8.17 90 90 90 *P4/nmm |
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.25 -.25 0 |
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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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As1 .75 .25 0 .003 .003 .004 0 0 0 |
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Zr1 .25 .25 .2599 .575 .006 .006 .003 0 0 0 |
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As2 .25 .25 .2599 .425 .006 .006 .003 0 0 0 |
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Zr2 .25 .25 .6192 .43 |
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Te1 .25 .25 .6192 .455 |
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(Ce(H2O))2(C2O4)2(CO3)*2.5H2O |
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Romero S, Mosset A, Trombe J |
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Journal of Solid State Chemistry 127 (1996) 256-266 |
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Two new families of lanthanide mixed-ligand complexes, oxalate-carbonate and |
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oxalate-formate: synthesis and and structure of (Ce(H2O))2(C2O4)2(CO3)*2.5H2O |
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_cod_database_code 1008972 |
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_database_code_amcsd 0016835 |
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6.329 8.743 13.004 105.59 90.47 105.13 P-1 |
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atom x y z occ |
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Ce1 .06026 .03013 .25725 |
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Ce2 .30963 .66699 .07528 |
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O1 .2649 .3183 .2837 |
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O2 .3358 .5412 .2240 |
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O3 -.0551 .1616 .1261 |
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O4 .0073 .3865 .0675 |
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O5 .4806 .2015 .0555 |
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O6 .3290 -.0283 .1030 |
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O7 .1857 .1479 .4542 |
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O8 .1418 .1282 .6209 |
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O9 .6619 .5693 .0761 |
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O10 .9870 .7310 .1601 |
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O11 .7031 .8307 .1602 |
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O12 .3607 .8971 .2936 |
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O13 -.2322 .1710 .3379 |
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O14 .7775 .4766 .3072 |
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O15 -.183 .2885 .5637 .5 |
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O16 -.357 .258 .5433 .5 |
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O17 -.464 .457 .5121 .5 |
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C1 .2326 .3961 .2191 |
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C2 .0433 .3057 .1295 |
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C3 .4460 .0512 .0455 |
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C4 .0937 .0805 .5216 |
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C5 .7854 .7080 .1310 |
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Ce H O6 |
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Romero S, Mosset A, Trombe J |
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Journal of Solid State Chemistry 127 (1996) 256-266 |
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Two new families of lanthanide mixed-ligand complexes, oxalate-carbonate and |
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oxalate-formate: synthesis and and structure of (Ce(H2O))2(C2O4)2(CO3)*2.5H2O |
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_cod_database_code 1008973 |
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_database_code_amcsd 0016836 |
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7.322 10.825 6.738 90 90 90 Pnma |
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atom x y z |
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Ce1 .21001 .25 .12921 |
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O1 .0454 .25 .4652 |
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O2 .0527 .25 .7925 |
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O3 .4207 .3781 .3551 |
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O4 .2699 .5397 .4766 |
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C1 .1237 .25 .628 |
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C2 .4092 .4779 .4536 |
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As2.79 Te5.1 Zr3.88 |
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Mosset A, Jeannin Y |
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Journal of the Less-Common Metals 26 (1972) 285-292 |
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Sur un Compose Ternaire Orthorhombique Forme Entre le Zirconium, |
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L'arsenic et le Tellure |
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_cod_database_code 1008118 |
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_database_code_amcsd 0016060 |
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5.64 13.37 3.78 90 90 90 Immm |
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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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Te1 0 .2931 .5 .0054 .0048 .0111 0 0 0 |
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Zr1 0 .1242 0 .97 .0068 .0023 .0101 0 0 0 |
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As1 .2528 .5 0 .7 .0262 .0039 .0103 0 0 0 |
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Te2 .2528 .5 0 .28 .0262 .0039 .0103 0 0 0 |
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Se1.99 Si1.9 Zr2 |
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Jeannin Y, Mosset A |
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Journal of the Less-Common Metals 27 (1971) 237-242 |
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Non-stoechiometrie du silicoseleniure de zirconium |
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_cod_database_code 1009068 |
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_database_code_amcsd 0016929 |
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3.624 3.624 8.360 90 90 90 P4/nmm |
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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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Zr1 0 .5 .2574 .0051 .0051 .0065 0 0 0 |
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Se1 0 .5 .6219 .995 .0065 .0065 .0089 0 0 0 |
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Si1 0 0 0 .950 .0056 .0056 .0043 0 0 0 |
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La2 O9 Si Ti2 |
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Benbertal D, Mosset A, Trombe J |
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Materials Research Bulletin 29 (1994) 47-54 |
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Synthese et structure cristalline d'un nouveau silicate de lanthane et de titane |
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_cod_database_code 1008953 |
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_database_code_amcsd 0016819 |
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17.02899 5.7415 7.631 90 111.221 90 C2/m |
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atom x y z |
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La1 .21084 0 .30163 |
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La2 .39449 .5 .30461 |
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Ti1 .5 .2581 0 |
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Ti2 .41795 0 .5494 |
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Si1 .3388 0 .0201 |
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O1 .3832 .2447 -.0119 |
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O2 .2455 0 .868 |
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O3 .3463 0 .2366 |
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O4 .3397 .2388 .5179 |
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O5 .5250 .5 .1791 |
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O6 .5 .2208 .5 |
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O7 .4728 0 .8149 |
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