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{
"id": "jvasp-80690",
"created_at": "2022-09-04T14:37:15.808201Z",
"updated_at": "2022-09-04T14:37:15.808225Z",
"structure_string": "Ca2 Zn1 Ga1\n1.0\n-11.970142 4.015223 -0.354133\n-8.521702 1.289008 2.341687\n-7.033076 5.499478 -0.236689\nCa Zn Ga\n2 1 1\ndirect\n0.749977 0.000013 0.000012 Ca\n0.250023 -0.000012 -0.000012 Ca\n0.000000 0.000000 0.000000 Zn\n0.500000 0.000000 -0.000000 Ga\n",
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{
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"structure_string": "Li2 Ac1 Tl1\n1.0\n-0.000000 3.646357 3.646357\n3.646357 0.000000 3.646357\n3.646357 3.646357 0.000000\nLi Ac Tl\n2 1 1\ndirect\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Li\n0.250000 0.250000 0.250000 Ac\n0.750001 0.750001 0.750001 Tl\n",
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{
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{
"id": "jvasp-102866",
"created_at": "2022-09-04T14:36:40.493630Z",
"updated_at": "2022-09-04T14:36:40.493650Z",
"structure_string": "Na3 Al1 Cl6\n1.0\n6.060918 0.000000 3.499272\n2.020306 5.714288 3.499272\n0.000000 0.000000 6.998544\nNa Al Cl\n3 1 6\ndirect\n0.750001 0.750000 0.749999 Na\n0.250000 0.250000 0.250000 Na\n0.500000 0.500000 0.499999 Na\n0.000000 0.000000 0.000000 Al\n0.765706 0.234295 0.234294 Cl\n0.234295 0.234295 0.765705 Cl\n0.234295 0.765706 0.765704 Cl\n0.234295 0.765706 0.234294 Cl\n0.765706 0.234295 0.765704 Cl\n0.765706 0.765706 0.234293 Cl\n",
"nsites": 10,
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"density_atomic": 0.04125644181252508,
"volume": 242.38639011675724,
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"formula_full": "Na3 Al1 Cl6",
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{
"id": "jvasp-40222",
"created_at": "2022-09-04T14:38:04.222116Z",
"updated_at": "2022-09-04T14:38:04.222135Z",
"structure_string": "Li1 Dy1 Tl2\n1.0\n0.000000 3.646182 3.646182\n3.646182 0.000000 3.646182\n3.646182 3.646182 0.000000\nLi Dy Tl\n1 1 2\ndirect\n0.750001 0.750001 0.750001 Li\n0.250001 0.250001 0.250001 Dy\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 Tl\n",
"nsites": 4,
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"elements": [
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{
"id": "jvasp-13017",
"created_at": "2022-09-04T14:37:03.774211Z",
"updated_at": "2022-09-04T14:37:03.774221Z",
"structure_string": "Ga2 Cu2 Cl8\n1.0\n5.302701 0.000000 -0.000000\n0.000000 5.302701 -0.000000\n0.000000 0.000000 10.343601\nGa Cu Cl\n2 2 8\ndirect\n0.500000 0.000000 0.750000 Ga\n0.000000 0.500000 0.250000 Ga\n0.000000 0.000000 0.500000 Cu\n0.000000 0.000000 0.000000 Cu\n0.263549 0.750961 0.627571 Cl\n0.750961 0.736451 0.372429 Cl\n0.249038 0.263549 0.372429 Cl\n0.736451 0.750961 0.872429 Cl\n0.263549 0.249038 0.872429 Cl\n0.736451 0.249038 0.627571 Cl\n0.750961 0.263549 0.127571 Cl\n0.249038 0.736451 0.127571 Cl\n",
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{
"id": "jvasp-41517",
"created_at": "2022-09-04T14:37:37.601565Z",
"updated_at": "2022-09-04T14:37:37.601584Z",
"structure_string": "Y1 Mg3\n1.0\n-0.000000 3.646151 3.646151\n3.646151 0.000000 3.646151\n3.646151 3.646151 0.000000\nY Mg\n1 3\ndirect\n0.750000 0.750000 0.750000 Y\n0.000000 0.000000 0.000000 Mg\n0.250000 0.250000 0.250000 Mg\n0.500000 0.500000 0.500000 Mg\n",
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{
"id": "jvasp-32166",
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"updated_at": "2022-09-04T14:37:48.101815Z",
"structure_string": "In4 Sb4 S12\n1.0\n3.882718 -0.000000 0.000000\n0.000000 9.444480 0.000000\n0.000000 0.000000 13.218657\nIn Sb S\n4 4 12\ndirect\n0.250000 0.153210 0.043858 In\n0.750000 0.846790 0.956142 In\n0.250000 0.653210 0.456142 In\n0.750000 0.346790 0.543858 In\n0.250000 0.524268 0.850719 Sb\n0.250000 0.024268 0.649281 Sb\n0.750000 0.975732 0.350719 Sb\n0.750000 0.475732 0.149281 Sb\n0.250000 -0.001127 0.882473 S\n0.750000 0.001127 0.117527 S\n0.250000 0.310902 0.208247 S\n0.750000 0.841422 0.520016 S\n0.250000 0.158578 0.479984 S\n0.750000 0.341422 0.979984 S\n0.250000 0.658578 0.020016 S\n0.750000 0.189098 0.708247 S\n0.250000 0.810902 0.291754 S\n0.750000 0.689098 0.791754 S\n0.750000 0.501127 0.382473 S\n0.250000 0.498873 0.617528 S\n",
"nsites": 20,
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"elements": [
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{
"id": "jvasp-100596",
"created_at": "2022-09-04T14:36:32.853774Z",
"updated_at": "2022-09-04T14:36:32.853799Z",
"structure_string": "Ga3 Te1\n1.0\n4.078428 0.003262 -4.277483\n-0.651294 4.026091 -4.277483\n-0.002774 -0.003262 5.910197\nGa Te\n3 1\ndirect\n0.750001 0.250000 0.500001 Ga\n0.250001 0.750000 0.500002 Ga\n0.500001 0.500000 0.000001 Ga\n0.000000 0.000000 0.000000 Te\n",
"nsites": 4,
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{
"id": "jvasp-16868",
"created_at": "2022-09-04T14:38:32.887589Z",
"updated_at": "2022-09-04T14:38:32.887617Z",
"structure_string": "Hf5 Te4\n1.0\n3.693641 -0.000000 0.918558\n1.846821 7.570190 0.459278\n0.019863 0.000001 7.805707\nHf Te\n5 4\ndirect\n0.688022 0.943144 0.680811 Hf\n0.368832 0.319190 0.943144 Hf\n0.631166 0.680810 0.056857 Hf\n0.311977 0.056856 0.319190 Hf\n0.000000 0.000000 0.000000 Hf\n0.948398 0.764700 0.338501 Te\n0.286900 0.661499 0.764701 Te\n0.713099 0.338500 0.235300 Te\n0.051600 0.235300 0.661500 Te\n",
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{
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"structure_string": "Cd1 P1 S4\n1.0\n-2.845443 2.845443 4.489913\n2.845443 -2.845443 4.489913\n2.845443 2.845443 -4.489913\nCd P S\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Cd\n0.749999 0.250000 0.500000 P\n0.806659 0.374606 0.926598 S\n0.448008 0.880060 0.073402 S\n0.625393 0.551991 0.432052 S\n0.119939 0.193341 0.567947 S\n",
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{
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"created_at": "2022-09-04T14:38:06.174899Z",
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"structure_string": "Ce3 Zn1\n1.0\n-2.282509 2.282509 4.651800\n2.282509 -2.282509 4.651800\n2.282509 2.282509 -4.651800\nCe Zn\n3 1\ndirect\n0.750000 0.250000 0.500000 Ce\n0.250000 0.750000 0.500000 Ce\n0.500000 0.500000 0.000000 Ce\n0.000000 0.000000 0.000000 Zn\n",
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