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{
"id": "jvasp-65131",
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{
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{
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"structure_string": "Sr1 Be1 Cu4\n1.0\n-0.000000 3.609037 3.609037\n3.609037 -0.000000 3.609037\n3.609037 3.609037 0.000000\nSr Be Cu\n1 1 4\ndirect\n0.250000 0.250000 0.250000 Sr\n0.000000 0.000000 0.000000 Be\n0.118334 0.627223 0.627223 Cu\n0.627223 0.627223 0.627223 Cu\n0.627223 0.118334 0.627223 Cu\n0.627223 0.627223 0.118334 Cu\n",
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{
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"structure_string": "Li1 Ca1 Mg6\n1.0\n6.708491 0.147425 0.000000\n-3.226572 5.588586 0.000000\n0.000000 0.000000 5.194372\nLi Ca Mg\n1 1 6\ndirect\n0.182400 0.841200 0.250000 Li\n0.147372 0.323686 0.250000 Ca\n0.650698 0.324785 0.250000 Mg\n0.650698 0.825914 0.250000 Mg\n0.345213 0.167908 0.750000 Mg\n0.345213 0.677307 0.750000 Mg\n0.818230 0.159116 0.750000 Mg\n0.860179 0.680091 0.750000 Mg\n",
"nsites": 8,
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"volume": 197.2129362148593,
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"formula_full": "Li1 Ca1 Mg6",
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"spacegroup": 38
},
{
"id": "jvasp-1996",
"created_at": "2022-09-04T14:35:41.412727Z",
"updated_at": "2022-09-04T14:35:41.412760Z",
"structure_string": "Na1 I1\n1.0\n3.937125 0.000000 2.273100\n1.312375 3.711957 2.273100\n0.000000 0.000000 4.546201\nNa I\n1 1\ndirect\n0.000000 0.000000 0.000000 Na\n0.500001 0.500000 0.499999 I\n",
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"elements": [
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"spacegroup": 225
},
{
"id": "jvasp-15985",
"created_at": "2022-09-04T14:35:43.318462Z",
"updated_at": "2022-09-04T14:35:43.318492Z",
"structure_string": "Rb6 As2\n1.0\n3.028910 -5.246226 0.000000\n3.028910 5.246226 -0.000000\n-0.000000 -0.000000 10.691612\nRb As\n6 2\ndirect\n0.333333 0.666667 0.580342 Rb\n0.666667 0.333333 0.080342 Rb\n0.666667 0.333333 0.419658 Rb\n0.333333 0.666667 0.919658 Rb\n0.000000 0.000000 0.750000 Rb\n0.000000 0.000000 0.250000 Rb\n0.666667 0.333333 0.750000 As\n0.333333 0.666667 0.250000 As\n",
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{
"id": "jvasp-107921",
"created_at": "2022-09-04T14:35:41.297999Z",
"updated_at": "2022-09-04T14:35:41.298027Z",
"structure_string": "Er1 Tm1 Hg2\n1.0\n4.485163 -0.000000 2.589510\n1.495054 4.228653 2.589510\n-0.000000 -0.000000 5.179021\nEr Tm Hg\n1 1 2\ndirect\n0.499999 0.500000 0.500000 Er\n0.000000 0.000000 0.000000 Tm\n0.250000 0.250000 0.250000 Hg\n0.749999 0.750000 0.750001 Hg\n",
"nsites": 4,
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{
"id": "jvasp-66405",
"created_at": "2022-09-04T14:35:43.828768Z",
"updated_at": "2022-09-04T14:35:43.828798Z",
"structure_string": "Ba1 Hg1 Sb1\n1.0\n-0.000000 3.957095 3.957095\n3.957095 0.000000 3.957095\n3.957095 3.957095 -0.000000\nBa Hg Sb\n1 1 1\ndirect\n0.749999 0.749999 0.749999 Ba\n0.000000 0.000000 0.000000 Hg\n0.499999 0.499999 0.499999 Sb\n",
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},
{
"id": "jvasp-3870",
"created_at": "2022-09-04T14:35:42.506971Z",
"updated_at": "2022-09-04T14:35:42.506982Z",
"structure_string": "Rb2 Se1 Cl6\n1.0\n6.113069 0.000000 3.529382\n2.037690 5.763457 3.529382\n0.000000 0.000000 7.058764\nRb Se Cl\n2 1 6\ndirect\n0.250000 0.250000 0.250000 Rb\n0.750000 0.750000 0.749999 Rb\n0.000000 0.000000 0.000000 Se\n0.244263 0.755738 0.755736 Cl\n0.244263 0.755738 0.244262 Cl\n0.755737 0.244263 0.755736 Cl\n0.755737 0.244263 0.244262 Cl\n0.755737 0.755738 0.244262 Cl\n0.244263 0.244263 0.755737 Cl\n",
"nsites": 9,
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},
{
"id": "jvasp-64512",
"created_at": "2022-09-04T14:35:42.256788Z",
"updated_at": "2022-09-04T14:35:42.256815Z",
"structure_string": "Ba4 Hg1 Sb1\n1.0\n-0.000000 4.998321 4.998321\n4.998321 0.000000 4.998321\n4.998321 4.998321 -0.000000\nBa Hg Sb\n4 1 1\ndirect\n0.120928 0.626357 0.626357 Ba\n0.626357 0.626357 0.626357 Ba\n0.626357 0.120928 0.626357 Ba\n0.626357 0.626357 0.120928 Ba\n0.250000 0.250000 0.250000 Hg\n0.000000 0.000000 0.000000 Sb\n",
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},
{
"id": "jvasp-86932",
"created_at": "2022-09-04T14:35:48.112659Z",
"updated_at": "2022-09-04T14:35:48.112685Z",
"structure_string": "Sr1 Zn5\n1.0\n5.557717 0.000000 0.000000\n-2.778858 4.813124 -0.000000\n0.000000 0.000000 4.260156\nSr Zn\n1 5\ndirect\n0.000000 0.000000 0.000000 Sr\n0.666667 0.333333 0.000000 Zn\n0.500000 0.000000 0.500000 Zn\n0.500000 0.500000 0.500000 Zn\n-0.000000 0.500000 0.500000 Zn\n0.333333 0.666666 0.000000 Zn\n",
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{
"id": "jvasp-94396",
"created_at": "2022-09-04T14:35:54.976738Z",
"updated_at": "2022-09-04T14:35:54.976764Z",
"structure_string": "Mg1 Zn5\n1.0\n5.061149 -0.000000 0.000000\n-2.530575 4.383084 0.000000\n-0.000000 -0.000000 4.337226\nMg Zn\n1 5\ndirect\n0.000000 0.000000 0.000000 Mg\n0.000000 0.367984 0.500000 Zn\n0.632016 0.632015 0.500000 Zn\n0.367984 0.000000 0.500000 Zn\n0.666667 0.333333 -0.000000 Zn\n0.333333 0.666666 -0.000000 Zn\n",
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