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{
"id": "jvasp-64603",
"created_at": "2022-09-04T14:38:13.130841Z",
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"structure_string": "Ba4 Mg1 Cd1\n1.0\n0.000000 5.163458 5.163458\n5.163458 0.000000 5.163458\n5.163458 5.163458 0.000000\nBa Mg Cd\n4 1 1\ndirect\n0.125787 0.624738 0.624738 Ba\n0.624738 0.624738 0.624738 Ba\n0.624738 0.125787 0.624738 Ba\n0.624738 0.624738 0.125787 Ba\n0.000000 0.000000 0.000000 Mg\n0.250000 0.250000 0.250000 Cd\n",
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{
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{
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{
"id": "jvasp-109484",
"created_at": "2022-09-04T14:38:19.028322Z",
"updated_at": "2022-09-04T14:38:19.028344Z",
"structure_string": "K1 Na2 As1 F6\n1.0\n5.496889 -0.000000 3.173630\n1.832296 5.182516 3.173630\n-0.000000 -0.000000 6.347260\nK Na As F\n1 2 1 6\ndirect\n0.500000 0.500000 0.500000 K\n0.750000 0.750001 0.749999 Na\n0.250000 0.250000 0.250000 Na\n0.000000 0.000000 0.000000 As\n0.771743 0.228257 0.228257 F\n0.228257 0.228257 0.771743 F\n0.228257 0.771744 0.771742 F\n0.228257 0.771744 0.228256 F\n0.771743 0.228257 0.771743 F\n0.771744 0.771744 0.228256 F\n",
"nsites": 10,
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"elements": [
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"density": 2.516168244907893,
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"volume": 180.81893513416935,
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"formula_full": "K1 Na2 As1 F6",
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{
"id": "jvasp-38895",
"created_at": "2022-09-04T14:38:13.179590Z",
"updated_at": "2022-09-04T14:38:13.179607Z",
"structure_string": "Tm2 Tl1 Cd1\n1.0\n-0.000000 3.695099 3.695099\n3.695099 0.000000 3.695099\n3.695099 3.695099 -0.000000\nTm Tl Cd\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Tm\n0.500000 0.500000 0.500000 Tm\n0.750001 0.750001 0.750001 Tl\n0.250000 0.250000 0.250000 Cd\n",
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{
"id": "jvasp-76954",
"created_at": "2022-09-04T14:38:13.081800Z",
"updated_at": "2022-09-04T14:38:13.081810Z",
"structure_string": "Ca1 Sc1 Hg2\n1.0\n-11.992578 2.822820 -2.314273\n-8.789672 0.578163 0.987239\n-7.312284 4.756848 -1.571672\nCa Sc Hg\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.500000 0.000001 0.000000 Sc\n0.749943 0.000029 0.000028 Hg\n0.250056 -0.000028 -0.000028 Hg\n",
"nsites": 4,
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{
"id": "jvasp-64870",
"created_at": "2022-09-04T14:38:13.048089Z",
"updated_at": "2022-09-04T14:38:13.048118Z",
"structure_string": "Ba4 Cd1 Cu1\n1.0\n-0.000000 5.144214 5.144214\n5.144214 -0.000000 5.144214\n5.144214 5.144214 0.000000\nBa Cd Cu\n4 1 1\ndirect\n0.125111 0.624963 0.624963 Ba\n0.624963 0.624963 0.624963 Ba\n0.624963 0.125111 0.624963 Ba\n0.624963 0.624963 0.125111 Ba\n0.250000 0.250000 0.250000 Cd\n0.000000 0.000000 0.000000 Cu\n",
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"formula_full": "Ba4 Cd1 Cu1",
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{
"id": "jvasp-64194",
"created_at": "2022-09-04T14:38:13.021285Z",
"updated_at": "2022-09-04T14:38:13.021298Z",
"structure_string": "Ba4 Hg1 Ge1\n1.0\n0.000000 4.959357 4.959357\n4.959357 0.000000 4.959357\n4.959357 4.959357 0.000000\nBa Hg Ge\n4 1 1\ndirect\n0.127811 0.624064 0.624064 Ba\n0.624064 0.624064 0.624064 Ba\n0.624064 0.127811 0.624064 Ba\n0.624064 0.624064 0.127811 Ba\n0.000000 0.000000 0.000000 Hg\n0.250000 0.250000 0.250000 Ge\n",
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},
{
"id": "jvasp-108024",
"created_at": "2022-09-04T14:38:12.952306Z",
"updated_at": "2022-09-04T14:38:12.952328Z",
"structure_string": "Ce1 Cd2 Cu1\n1.0\n4.312633 0.000000 2.489900\n1.437544 4.065990 2.489900\n0.000000 0.000000 4.979800\nCe Cd Cu\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Ce\n0.250000 0.250000 0.250000 Cd\n0.499999 0.500000 0.500000 Cd\n0.749999 0.750000 0.750001 Cu\n",
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{
"id": "jvasp-16500",
"created_at": "2022-09-04T14:38:12.861605Z",
"updated_at": "2022-09-04T14:38:12.861631Z",
"structure_string": "Tb1 Cu5\n1.0\n2.519612 -4.364097 -0.000000\n2.519612 4.364097 0.000000\n0.000000 -0.000000 4.103107\nTb Cu\n1 5\ndirect\n0.000000 0.000000 0.000000 Tb\n-0.000000 0.500000 0.500000 Cu\n0.333332 0.666667 0.000000 Cu\n0.666667 0.333332 0.000000 Cu\n0.500000 0.500000 0.500000 Cu\n0.500000 -0.000000 0.500000 Cu\n",
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},
{
"id": "jvasp-34430",
"created_at": "2022-09-04T14:38:13.009353Z",
"updated_at": "2022-09-04T14:38:13.009381Z",
"structure_string": "Tl1 Cu1 F3\n1.0\n4.115072 0.000000 0.000000\n0.000000 4.115072 0.000000\n0.000000 0.000000 4.114485\nTl Cu F\n1 1 3\ndirect\n0.500000 0.500000 0.499999 Tl\n0.000000 0.000000 0.000000 Cu\n0.000000 0.000000 0.499999 F\n0.500000 0.000000 0.000000 F\n0.000000 0.500000 0.000000 F\n",
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},
{
"id": "jvasp-12756",
"created_at": "2022-09-04T14:38:12.732534Z",
"updated_at": "2022-09-04T14:38:12.732555Z",
"structure_string": "Tl1 Hg5 Cl11\n1.0\n6.153213 0.009862 -1.961650\n-3.465239 8.346013 -1.682114\n0.014720 0.042178 9.191917\nTl Hg Cl\n1 5 11\ndirect\n-0.000000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 Hg\n0.312519 0.484610 0.145220 Hg\n0.687480 0.854780 0.515390 Hg\n0.687480 0.515390 0.854781 Hg\n0.312519 0.145219 0.484610 Hg\n0.083771 0.669871 0.914820 Cl\n0.083770 0.914819 0.669871 Cl\n0.916228 0.330129 0.085181 Cl\n0.293241 0.798342 0.354063 Cl\n0.293241 0.354062 0.798343 Cl\n0.706758 0.201658 0.645938 Cl\n0.916229 0.085181 0.330129 Cl\n0.399885 0.149284 0.149285 Cl\n0.600114 0.850715 0.850716 Cl\n0.706758 0.645937 0.201658 Cl\n0.499999 0.500000 0.500000 Cl\n",
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