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{
"id": "jvasp-65131",
"created_at": "2022-09-04T14:35:41.890638Z",
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"structure_string": "Be1 Zn1 Cd4\n1.0\n0.000000 4.016365 4.016365\n4.016365 -0.000000 4.016365\n4.016365 4.016365 -0.000000\nBe Zn Cd\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 Zn\n0.124247 0.625252 0.625252 Cd\n0.625252 0.625252 0.625252 Cd\n0.625252 0.124247 0.625252 Cd\n0.625252 0.625252 0.124247 Cd\n",
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{
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"structure_string": "Mg2\n1.0\n1.589411 -2.752940 -0.000000\n1.589411 2.752940 0.000000\n0.000000 0.000000 5.170851\nMg\n2\ndirect\n0.333333 0.666667 0.250000 Mg\n0.666667 0.333333 0.750000 Mg\n",
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{
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"structure_string": "Na1 Mg6 Co1\n1.0\n7.092819 -1.904137 0.000000\n-5.200881 8.959866 0.000000\n0.000000 0.000000 3.205962\nNa Mg Co\n1 6 1\ndirect\n0.249943 0.874970 0.250000 Na\n0.750069 0.375044 0.250000 Mg\n0.750062 0.875029 0.250000 Mg\n0.249625 0.171321 0.749999 Mg\n0.250450 0.578711 0.749999 Mg\n0.842975 0.171300 0.749999 Mg\n0.656942 0.578661 0.749999 Mg\n0.249938 0.374965 0.250000 Co\n",
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{
"id": "jvasp-94731",
"created_at": "2022-09-04T14:35:41.445406Z",
"updated_at": "2022-09-04T14:35:41.445427Z",
"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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"elements": [
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"density_atomic": 0.040565290257045666,
"volume": 197.2129362148593,
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"formula_full": "Li1 Ca1 Mg6",
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"spacegroup": 38
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{
"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",
"nsites": 2,
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"volume": 66.44017584885867,
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},
{
"id": "jvasp-94183",
"created_at": "2022-09-04T14:35:47.541272Z",
"updated_at": "2022-09-04T14:35:47.541292Z",
"structure_string": "Mg6 V1 Cu1\n1.0\n6.132823 0.020690 0.000000\n-3.048495 5.280146 0.000000\n0.000000 0.000000 4.855058\nMg V Cu\n6 1 1\ndirect\n0.661468 0.333180 0.250000 Mg\n0.661469 0.828289 0.250000 Mg\n0.325521 0.161990 0.750000 Mg\n0.325521 0.663534 0.750000 Mg\n0.851460 0.175731 0.750000 Mg\n0.845529 0.672766 0.750000 Mg\n0.160765 0.830382 0.250000 V\n0.168268 0.334133 0.250000 Cu\n",
"nsites": 8,
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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",
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"spacegroup": 225
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{
"id": "jvasp-108001",
"created_at": "2022-09-04T14:35:43.784481Z",
"updated_at": "2022-09-04T14:35:43.784501Z",
"structure_string": "Yb3 Al1\n1.0\n4.719584 -0.000000 2.724853\n1.573195 4.449667 2.724853\n-0.000000 -0.000000 5.449706\nYb Al\n3 1\ndirect\n0.749998 0.750001 0.750000 Yb\n0.249999 0.250000 0.250000 Yb\n0.499999 0.500000 0.500000 Yb\n0.000000 0.000000 0.000000 Al\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",
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"volume": 248.69726959674804,
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"formula_full": "Rb2 Se1 Cl6",
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"spacegroup": 225
},
{
"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-93160",
"created_at": "2022-09-04T14:35:47.315839Z",
"updated_at": "2022-09-04T14:35:47.315865Z",
"structure_string": "Li1 Mg6 Sb1\n1.0\n6.372989 0.023311 0.000000\n-3.166308 5.530825 0.000000\n0.000000 0.000000 5.073898\nLi Mg Sb\n1 6 1\ndirect\n0.166690 0.333310 0.250000 Li\n0.163104 0.821549 0.250000 Mg\n0.678451 0.336896 0.250000 Mg\n0.664122 0.835879 0.250000 Mg\n0.332910 0.663809 0.750000 Mg\n0.836192 0.167090 0.750000 Mg\n0.831604 0.668396 0.750000 Mg\n0.326924 0.173076 0.750000 Sb\n",
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{
"id": "jvasp-91878",
"created_at": "2022-09-04T14:36:01.987650Z",
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"structure_string": "Y1 Mg7\n1.0\n6.618014 -0.000000 0.000000\n-3.309008 5.731367 -0.000000\n-0.000000 -0.000000 5.137178\nY Mg\n1 7\ndirect\n0.166667 0.333333 0.250000 Y\n0.173641 0.836820 0.250000 Mg\n0.663180 0.326359 0.250000 Mg\n0.663180 0.836820 0.250000 Mg\n0.335766 0.164234 0.750000 Mg\n0.335766 0.671535 0.750000 Mg\n0.828464 0.164234 0.750000 Mg\n0.833332 0.666667 0.750000 Mg\n",
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