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"id": "jvasp-95036",
"created_at": "2022-09-04T14:36:04.186917Z",
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{
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{
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"structure_string": "Sr2 Mg4\n1.0\n3.813370 0.000000 0.000000\n-1.906684 3.302475 -0.000000\n-0.000000 -0.000000 16.122612\nSr Mg\n2 4\ndirect\n0.666668 0.333333 0.750000 Sr\n0.333334 0.666668 0.250000 Sr\n0.333334 0.666668 0.928363 Mg\n0.333334 0.666668 0.571637 Mg\n0.666668 0.333333 0.428363 Mg\n0.666668 0.333333 0.071637 Mg\n",
"nsites": 6,
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{
"id": "jvasp-93887",
"created_at": "2022-09-04T14:35:50.943919Z",
"updated_at": "2022-09-04T14:35:50.943949Z",
"structure_string": "Na2 As4\n1.0\n-4.056036 -4.056036 -0.000000\n-4.056036 -0.000000 -4.056036\n0.000000 -4.056036 -4.056036\nNa As\n2 4\ndirect\n0.125000 0.125000 0.125000 Na\n0.875001 0.875001 0.875001 Na\n0.500000 0.500000 0.000000 As\n0.500000 0.000000 0.500000 As\n0.000000 0.500000 0.500000 As\n0.500000 0.500000 0.500000 As\n",
"nsites": 6,
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"elements": [
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"density_atomic": 0.04495891809995642,
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{
"id": "jvasp-86944",
"created_at": "2022-09-04T14:36:03.939020Z",
"updated_at": "2022-09-04T14:36:03.939045Z",
"structure_string": "Sr2 Cd4\n1.0\n4.664776 -0.000000 2.009318\n2.181948 5.844864 1.353917\n0.015326 0.047150 6.383882\nSr Cd\n2 4\ndirect\n0.457547 0.292454 0.792454 Sr\n0.542456 0.707545 0.207546 Sr\n0.835204 0.113751 0.215843 Cd\n0.164799 0.886248 0.784157 Cd\n0.164798 0.284157 0.386249 Cd\n0.835204 0.715842 0.613751 Cd\n",
"nsites": 6,
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"volume": 173.7853621012635,
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{
"id": "jvasp-86547",
"created_at": "2022-09-04T14:35:50.907612Z",
"updated_at": "2022-09-04T14:35:50.907637Z",
"structure_string": "C6 F12\n1.0\n5.603261 -0.050305 -1.813350\n-0.635479 6.130816 -0.282103\n0.096338 -0.028546 6.390947\nC F\n6 12\ndirect\n0.551637 0.826847 0.771337 C\n0.448363 0.173154 0.228664 C\n0.343645 0.740824 0.629061 C\n0.656355 0.259177 0.370940 C\n0.248968 0.290003 0.099987 C\n0.751032 0.709998 0.900014 C\n0.275258 0.529416 0.578156 F\n0.181844 0.862891 0.522426 F\n0.598086 0.047425 0.807078 F\n0.049142 0.247051 0.165178 F\n0.184928 0.223308 0.882571 F\n0.815072 0.776693 0.117430 F\n0.950858 0.752950 0.834824 F\n0.818156 0.137110 0.477575 F\n0.724742 0.470585 0.421845 F\n0.692214 0.490480 0.876784 F\n0.307786 0.509521 0.123217 F\n0.401914 0.952575 0.192924 F\n",
"nsites": 18,
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"elements": [
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"formula_full": "C6 F12",
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{
"id": "jvasp-93434",
"created_at": "2022-09-04T14:35:51.157699Z",
"updated_at": "2022-09-04T14:35:51.157717Z",
"structure_string": "Sr2 Hg4\n1.0\n4.669017 -0.000000 2.012602\n2.068297 5.811086 1.623883\n0.019301 0.113644 6.377326\nSr Hg\n2 4\ndirect\n0.485475 0.264525 0.764526 Sr\n0.514526 0.735475 0.235474 Sr\n0.833620 0.683605 0.649155 Hg\n0.166381 0.850844 0.816395 Hg\n0.833620 0.149156 0.183605 Hg\n0.166381 0.316395 0.350844 Hg\n",
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"volume": 172.41567386809476,
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"formula_full": "Sr2 Hg4",
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"energy_above_hull": 0.11292,
"spacegroup": 74
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{
"id": "jvasp-86823",
"created_at": "2022-09-04T14:35:50.818547Z",
"updated_at": "2022-09-04T14:35:50.818574Z",
"structure_string": "Er4 Ru8\n1.0\n5.232612 -0.000000 0.000000\n-2.616306 4.531575 -0.000000\n-0.000000 -0.000000 8.859955\nEr Ru\n4 8\ndirect\n0.333332 0.666666 0.432932 Er\n0.666666 0.333333 0.567068 Er\n0.666666 0.333333 0.932933 Er\n0.333332 0.666666 0.067068 Er\n0.171026 0.342054 0.750000 Ru\n0.171025 0.828973 0.750000 Ru\n0.342054 0.171026 0.250000 Ru\n0.828972 0.657945 0.250000 Ru\n0.657944 0.828973 0.750000 Ru\n0.000000 0.000000 0.000000 Ru\n0.828973 0.171026 0.250000 Ru\n0.000000 0.000000 0.500000 Ru\n",
"nsites": 12,
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"elements": [
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"volume": 210.0870201549364,
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{
"id": "jvasp-28409",
"created_at": "2022-09-04T14:36:03.974098Z",
"updated_at": "2022-09-04T14:36:03.974124Z",
"structure_string": "Te2 Mo1\n1.0\n3.562562 -0.000000 0.000015\n-1.781280 3.085270 -0.000014\n0.000065 -0.000034 16.371633\nTe Mo\n2 1\ndirect\n0.666669 0.333331 0.106427 Te\n0.666663 0.333336 0.327745 Te\n0.333333 0.666667 0.217091 Mo\n",
"nsites": 3,
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{
"id": "jvasp-14940",
"created_at": "2022-09-04T14:35:50.774413Z",
"updated_at": "2022-09-04T14:35:50.774441Z",
"structure_string": "Nd1 Ga2\n1.0\n2.132278 -3.693215 -0.000000\n2.132278 3.693215 0.000000\n-0.000000 0.000000 4.287458\nNd Ga\n1 2\ndirect\n0.000000 0.000000 0.000000 Nd\n0.333333 0.666668 0.500000 Ga\n0.666668 0.333333 0.500000 Ga\n",
"nsites": 3,
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{
"id": "jvasp-86689",
"created_at": "2022-09-04T14:35:51.405079Z",
"updated_at": "2022-09-04T14:35:51.405094Z",
"structure_string": "Y4 Ru8\n1.0\n5.259584 0.000000 -0.000000\n-2.629792 4.554934 0.000000\n0.000000 0.000000 8.931593\nY Ru\n4 8\ndirect\n0.333333 0.666666 0.432857 Y\n0.666667 0.333333 0.567143 Y\n0.666667 0.333333 0.932857 Y\n0.333333 0.666666 0.067143 Y\n0.170523 0.341046 0.750000 Ru\n0.170523 0.829476 0.750000 Ru\n0.341046 0.170523 0.250000 Ru\n0.829477 0.658953 0.250000 Ru\n0.658953 0.829476 0.750000 Ru\n0.000000 0.000000 0.000000 Ru\n0.829477 0.170523 0.250000 Ru\n0.000000 0.000000 0.500000 Ru\n",
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{
"id": "jvasp-2026",
"created_at": "2022-09-04T14:36:04.007159Z",
"updated_at": "2022-09-04T14:36:04.007183Z",
"structure_string": "Ni1 Br2\n1.0\n3.516727 0.005593 5.352456\n1.605198 3.129015 5.352456\n0.009139 0.005593 6.404379\nNi Br\n1 2\ndirect\n0.000000 0.000000 0.000000 Ni\n0.255499 0.255499 0.255499 Br\n0.744503 0.744501 0.744501 Br\n",
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