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{
"id": "jvasp-92296",
"created_at": "2022-09-04T14:35:50.963649Z",
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{
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"structure_string": "Mg1 Be2 N2\n1.0\n1.477014 -2.558264 0.000000\n1.477014 2.558264 0.000000\n0.000000 0.000000 5.088482\nMg Be N\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Mg\n0.666665 0.333332 0.371569 Be\n0.333332 0.666665 0.628430 Be\n0.666665 0.333332 0.722605 N\n0.333332 0.666665 0.277395 N\n",
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{
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"structure_string": "Dy1 Fe2 Si2\n1.0\n3.725269 -0.000000 -1.360666\n-0.496987 3.691969 -1.360666\n-0.093884 -0.107369 5.522870\nDy Fe Si\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Dy\n0.250000 0.750000 0.499999 Fe\n0.750001 0.250000 0.499999 Fe\n0.634347 0.634348 0.268694 Si\n0.365653 0.365652 0.731305 Si\n",
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{
"id": "jvasp-3501",
"created_at": "2022-09-04T14:35:51.475700Z",
"updated_at": "2022-09-04T14:35:51.475740Z",
"structure_string": "Na2 Pt1 O2\n1.0\n3.041988 0.000000 -0.892742\n-0.557716 4.142692 -1.900398\n-0.037511 -0.025160 5.501291\nNa Pt O\n2 1 2\ndirect\n0.675363 0.675380 0.350726 Na\n0.324636 0.324619 0.649274 Na\n0.000000 0.000000 0.000000 Pt\n0.359869 0.859832 0.719740 O\n0.640130 0.140168 0.280259 O\n",
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"elements": [
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"volume": 69.03066990988184,
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"formula_full": "Na2 Pt1 O2",
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{
"id": "jvasp-86905",
"created_at": "2022-09-04T14:35:51.531799Z",
"updated_at": "2022-09-04T14:35:51.531815Z",
"structure_string": "Ba2 Sb4 Au4\n1.0\n4.902297 0.000000 0.000000\n0.000000 5.017059 -0.093455\n0.000000 0.012581 11.107790\nBa Sb Au\n2 4 4\ndirect\n0.250000 0.261390 0.756538 Ba\n0.750000 0.738610 0.243462 Ba\n0.750000 0.246820 0.501172 Sb\n0.250000 0.753180 0.498827 Sb\n0.250000 0.198110 0.123062 Sb\n0.750000 0.801890 0.876938 Sb\n0.750000 0.304155 0.000554 Au\n0.750000 0.746567 0.631508 Au\n0.250000 0.253434 0.368492 Au\n0.250000 0.695845 0.999445 Au\n",
"nsites": 10,
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"elements": [
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"volume": 273.2031173024459,
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"formula_full": "Ba2 Sb4 Au4",
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"spacegroup": 11
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{
"id": "jvasp-15268",
"created_at": "2022-09-04T14:35:51.601446Z",
"updated_at": "2022-09-04T14:35:51.601466Z",
"structure_string": "Sr1 P2 Ru2\n1.0\n3.847792 0.000000 -1.310338\n-0.446226 3.821831 -1.310338\n0.001618 0.001818 6.309420\nSr P Ru\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.647532 0.647533 0.295065 P\n0.352467 0.352467 0.704935 P\n0.750000 0.250000 0.500000 Ru\n0.249999 0.750000 0.500000 Ru\n",
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"elements": [
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"spacegroup": 139
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{
"id": "jvasp-14920",
"created_at": "2022-09-04T14:35:51.696725Z",
"updated_at": "2022-09-04T14:35:51.696741Z",
"structure_string": "Li2 Nd1 As2\n1.0\n2.133431 -3.695211 0.000000\n2.133431 3.695211 0.000000\n-0.000000 -0.000000 7.007083\nLi Nd As\n2 1 2\ndirect\n0.666667 0.333333 0.377051 Li\n0.333333 0.666667 0.622949 Li\n0.000000 0.000000 0.000000 Nd\n0.666667 0.333333 0.753681 As\n0.333333 0.666667 0.246319 As\n",
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"elements": [
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"volume": 110.48036513025718,
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"formula_full": "Li2 Nd1 As2",
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"spacegroup": 164
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{
"id": "jvasp-15648",
"created_at": "2022-09-04T14:35:51.756875Z",
"updated_at": "2022-09-04T14:35:51.756890Z",
"structure_string": "Pr1 Si2 Os2\n1.0\n3.955986 -0.000000 -1.533999\n-0.594834 3.911010 -1.533999\n-0.022348 -0.026003 5.810358\nPr Si Os\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Pr\n0.633315 0.633314 0.266628 Si\n0.366687 0.366687 0.733373 Si\n0.250001 0.750000 0.500000 Os\n0.750001 0.250000 0.500000 Os\n",
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"volume": 89.58168039274935,
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"formula_full": "Pr1 Si2 Os2",
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"formula_anonymous": "AB2C2",
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"spacegroup": 139
},
{
"id": "jvasp-86447",
"created_at": "2022-09-04T14:35:51.788168Z",
"updated_at": "2022-09-04T14:35:51.788179Z",
"structure_string": "V2 Cr4 C4\n1.0\n2.847629 -0.000000 0.000000\n-1.423815 4.592533 -0.000000\n0.000000 -0.000000 7.101161\nV Cr C\n2 4 4\ndirect\n0.404364 0.808725 0.750000 V\n0.595638 0.191274 0.250000 V\n0.140546 0.281092 0.573513 Cr\n0.859456 0.718907 0.426487 Cr\n0.859456 0.718907 0.073513 Cr\n0.140546 0.281092 0.926487 Cr\n0.249553 0.499104 0.250000 C\n0.750449 0.500895 0.750000 C\n0.500000 0.000000 0.500000 C\n0.500000 0.000000 0.000000 C\n",
"nsites": 10,
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"elements": [
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],
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"density": 6.399677969207228,
"density_atomic": 0.10767997548702271,
"volume": 92.8677774560338,
"volume_molar": 5.592628279085903,
"formula_full": "V2 Cr4 C4",
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"spacegroup": 63
},
{
"id": "jvasp-98212",
"created_at": "2022-09-04T14:35:51.788859Z",
"updated_at": "2022-09-04T14:35:51.788890Z",
"structure_string": "Ce1 Mn2 Ge2\n1.0\n3.838539 -0.000000 -1.358457\n-0.480757 3.808314 -1.358457\n-0.088360 -0.100216 5.852757\nCe Mn Ge\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ce\n0.249999 0.749999 0.499999 Mn\n0.750000 0.249999 0.500000 Mn\n0.630530 0.630529 0.261060 Ge\n0.369469 0.369468 0.738939 Ge\n",
"nsites": 5,
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{
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"structure_string": "Na2 H2 Pd1\n1.0\n3.411681 0.000000 -1.033912\n-0.313328 3.397263 -1.033912\n0.007018 0.007694 6.169009\nNa H Pd\n2 2 1\ndirect\n0.640302 0.640301 0.280604 Na\n0.359698 0.359697 0.719396 Na\n0.848708 0.848706 0.697416 H\n0.151292 0.151291 0.302584 H\n0.000000 0.000000 0.000000 Pd\n",
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{
"id": "jvasp-18829",
"created_at": "2022-09-04T14:35:51.900469Z",
"updated_at": "2022-09-04T14:35:51.900486Z",
"structure_string": "Nd1 Si2 Ag2\n1.0\n3.998928 -0.000000 -1.465942\n-0.537391 3.962655 -1.465942\n-0.017997 -0.020602 6.138192\nNd Si Ag\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Nd\n0.609282 0.609283 0.218564 Si\n0.390718 0.390719 0.781436 Si\n0.250000 0.750001 0.500000 Ag\n0.750000 0.250001 0.500000 Ag\n",
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