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"id": "jvasp-16550",
"created_at": "2022-09-04T14:38:15.281306Z",
"updated_at": "2022-09-04T14:38:15.281337Z",
"structure_string": "Na1 Hg2\n1.0\n2.576506 -4.462640 -0.000000\n2.576506 4.462640 -0.000000\n-0.000000 -0.000000 3.276846\nNa Hg\n1 2\ndirect\n0.000000 0.000000 0.000000 Na\n0.666668 0.333334 0.500001 Hg\n0.333334 0.666668 0.500001 Hg\n",
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{
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"structure_string": "Nd1 Hg1\n1.0\n3.814922 0.000000 -0.000000\n0.000000 3.814922 -0.000000\n0.000000 0.000000 3.814922\nNd Hg\n1 1\ndirect\n0.500000 0.500000 0.500000 Nd\n0.000000 0.000000 0.000000 Hg\n",
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{
"id": "jvasp-16552",
"created_at": "2022-09-04T14:37:43.073992Z",
"updated_at": "2022-09-04T14:37:43.074014Z",
"structure_string": "Nd1 Hg2\n1.0\n2.518071 -4.361426 0.000000\n2.518071 4.361426 -0.000000\n-0.000000 0.000000 3.469633\nNd Hg\n1 2\ndirect\n0.000000 0.000000 0.000000 Nd\n0.666667 0.333333 0.499882 Hg\n0.333333 0.666667 0.500117 Hg\n",
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{
"id": "jvasp-16553",
"created_at": "2022-09-04T14:37:43.197213Z",
"updated_at": "2022-09-04T14:37:43.197235Z",
"structure_string": "Pr1 Hg1\n1.0\n3.842495 0.000000 -0.000000\n-0.000000 3.842495 -0.000000\n0.000000 0.000000 3.842495\nPr Hg\n1 1\ndirect\n0.499999 0.499999 0.499999 Pr\n0.000000 0.000000 0.000000 Hg\n",
"nsites": 2,
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"elements": [
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"density": 9.99532416925679,
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"spacegroup": 221
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{
"id": "jvasp-16554",
"created_at": "2022-09-04T14:37:43.380160Z",
"updated_at": "2022-09-04T14:37:43.380183Z",
"structure_string": "Hg2 Pt1\n1.0\n4.817073 0.000000 0.000000\n-0.000000 4.817073 -0.000000\n0.000000 -0.000000 2.986830\nHg Pt\n2 1\ndirect\n0.000000 0.500000 0.500000 Hg\n0.500000 0.000000 0.500000 Hg\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 3,
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"elements": [
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"density": 14.2860026448351,
"density_atomic": 0.04328568495900819,
"volume": 69.30697764956287,
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"formula_full": "Hg2 Pt1",
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"formula_anonymous": "AB2",
"energy_above_hull": 0.5406135666666665,
"spacegroup": 123
},
{
"id": "jvasp-16555",
"created_at": "2022-09-04T14:37:43.390663Z",
"updated_at": "2022-09-04T14:37:43.390694Z",
"structure_string": "Sc1 Hg1\n1.0\n3.501785 -0.000000 -0.000000\n0.000000 3.501785 0.000000\n0.000000 0.000000 3.501785\nSc Hg\n1 1\ndirect\n0.499999 0.499999 0.499999 Sc\n0.000000 0.000000 0.000000 Hg\n",
"nsites": 2,
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"elements": [
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"density": 9.4954023386503,
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"volume": 42.94063221104991,
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"formula_anonymous": "AB",
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"spacegroup": 221
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{
"id": "jvasp-16556",
"created_at": "2022-09-04T14:37:43.459127Z",
"updated_at": "2022-09-04T14:37:43.459153Z",
"structure_string": "Sr1 Hg2\n1.0\n2.544897 -4.407892 0.000000\n2.544897 4.407892 -0.000000\n0.000000 -0.000000 3.849200\nSr Hg\n1 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.333334 0.666668 0.500000 Hg\n0.666668 0.333334 0.500000 Hg\n",
"nsites": 3,
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"elements": [
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"density": 9.398935451773967,
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"volume": 86.35781146905141,
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"formula_anonymous": "AB2",
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{
"id": "jvasp-16557",
"created_at": "2022-09-04T14:38:14.973102Z",
"updated_at": "2022-09-04T14:38:14.973128Z",
"structure_string": "Tl1 Hg1\n1.0\n3.859268 -0.000000 0.000000\n-0.000000 3.859268 -0.000000\n0.000000 -0.000000 3.859268\nTl Hg\n1 1\ndirect\n0.500000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 Hg\n",
"nsites": 2,
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"elements": [
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"density": 11.699321433819998,
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"volume": 57.479742682849704,
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"spacegroup": 221
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{
"id": "jvasp-16558",
"created_at": "2022-09-04T14:38:13.589715Z",
"updated_at": "2022-09-04T14:38:13.589741Z",
"structure_string": "Tl1 Hg3\n1.0\n4.825841 0.000000 0.000000\n-0.000000 4.825841 0.000000\n-0.000000 -0.000000 4.825841\nTl Hg\n1 3\ndirect\n0.000000 0.000000 0.000000 Tl\n0.000000 0.500000 0.500000 Hg\n0.500000 0.500000 0.000000 Hg\n0.500000 0.000000 0.500000 Hg\n",
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"elements": [
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"density": 11.91098580495381,
"density_atomic": 0.03559106345286038,
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"formula_full": "Tl1 Hg3",
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"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 221
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{
"id": "jvasp-16559",
"created_at": "2022-09-04T14:38:17.702948Z",
"updated_at": "2022-09-04T14:38:17.702975Z",
"structure_string": "Tm1 Hg1\n1.0\n3.646811 0.000000 -0.000000\n-0.000000 3.646811 -0.000000\n-0.000000 0.000000 3.646811\nTm Hg\n1 1\ndirect\n0.500000 0.500000 0.500000 Tm\n0.000000 0.000000 0.000000 Hg\n",
"nsites": 2,
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"elements": [
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{
"id": "jvasp-16560",
"created_at": "2022-09-04T14:38:14.992830Z",
"updated_at": "2022-09-04T14:38:14.992857Z",
"structure_string": "Ho1 Ir1\n1.0\n3.403354 0.000000 0.000000\n0.000000 3.403354 0.000000\n-0.000000 -0.000000 3.403354\nHo Ir\n1 1\ndirect\n0.000000 0.000000 0.000000 Ho\n0.499999 0.499999 0.499999 Ir\n",
"nsites": 2,
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"elements": [
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"density": 15.044408567170477,
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"volume": 39.42043150075341,
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"formula_full": "Ho1 Ir1",
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"energy_above_hull": 1.5166683333333326,
"spacegroup": 221
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{
"id": "jvasp-16561",
"created_at": "2022-09-04T14:37:43.677784Z",
"updated_at": "2022-09-04T14:37:43.677804Z",
"structure_string": "Ho1 Sn3\n1.0\n4.707337 0.000000 -0.000000\n0.000000 4.707337 -0.000000\n-0.000000 0.000000 4.707337\nHo Sn\n1 3\ndirect\n0.000000 0.000000 0.000000 Ho\n0.500000 0.000000 0.500000 Sn\n0.000000 0.500000 0.500000 Sn\n0.500000 0.500000 0.000000 Sn\n",
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