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{
"id": "jvasp-64057",
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"structure_string": "Ba4 Fe1 Sn1\n1.0\n-0.000000 4.907222 4.907222\n4.907222 0.000000 4.907222\n4.907222 4.907222 -0.000000\nBa Fe Sn\n4 1 1\ndirect\n0.124610 0.625130 0.625130 Ba\n0.625130 0.625130 0.625130 Ba\n0.625130 0.124610 0.625130 Ba\n0.625130 0.625130 0.124610 Ba\n0.250000 0.250000 0.250000 Fe\n0.000000 0.000000 0.000000 Sn\n",
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"structure_string": "Ba1 In1 Br1\n1.0\n0.000000 4.018357 4.018357\n4.018357 0.000000 4.018357\n4.018357 4.018357 0.000000\nBa In Br\n1 1 1\ndirect\n0.750001 0.750001 0.750001 Ba\n0.500000 0.500000 0.500000 In\n0.000000 0.000000 0.000000 Br\n",
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{
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"structure_string": "Ca4 Be1 Rh1\n1.0\n-0.000000 4.243119 4.243119\n4.243119 0.000000 4.243119\n4.243119 4.243119 -0.000000\nCa Be Rh\n4 1 1\ndirect\n0.127639 0.624121 0.624121 Ca\n0.624121 0.624121 0.624121 Ca\n0.624121 0.127639 0.624121 Ca\n0.624121 0.624121 0.127639 Ca\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 Rh\n",
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"elements": [
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"formula_full": "Ca4 Be1 Rh1",
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{
"id": "jvasp-67743",
"created_at": "2022-09-04T14:35:57.904736Z",
"updated_at": "2022-09-04T14:35:57.904759Z",
"structure_string": "Mg1 Be1 Ru2\n1.0\n-2.111734 2.111734 2.983180\n2.111734 -2.111734 2.983180\n2.111734 2.111734 -2.983180\nMg Be Ru\n1 1 2\ndirect\n0.749999 0.250000 0.499999 Mg\n0.500000 0.500000 0.000000 Be\n0.000000 0.000000 0.000000 Ru\n0.250000 0.749999 0.499999 Ru\n",
"nsites": 4,
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"density": 7.347560397569022,
"density_atomic": 0.07516957876791949,
"volume": 53.21301603072307,
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"formula_full": "Mg1 Be1 Ru2",
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{
"id": "jvasp-67727",
"created_at": "2022-09-04T14:35:57.918640Z",
"updated_at": "2022-09-04T14:35:57.918667Z",
"structure_string": "Li1 Be1 Br4\n1.0\n0.000000 4.525120 4.525120\n4.525120 0.000000 4.525120\n4.525120 4.525120 -0.000000\nLi Be Br\n1 1 4\ndirect\n0.250000 0.250000 0.250000 Li\n0.000000 0.000000 0.000000 Be\n0.625454 0.123636 0.625454 Br\n0.123636 0.625454 0.625454 Br\n0.625454 0.625454 0.625454 Br\n0.625454 0.625454 0.123636 Br\n",
"nsites": 6,
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"volume": 185.3191490909635,
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"formula_full": "Li1 Be1 Br4",
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{
"id": "jvasp-66423",
"created_at": "2022-09-04T14:35:57.553877Z",
"updated_at": "2022-09-04T14:35:57.553903Z",
"structure_string": "Ba4 Ti1 V1\n1.0\n0.000000 4.859895 4.859895\n4.859895 0.000000 4.859895\n4.859895 4.859895 0.000000\nBa Ti V\n4 1 1\ndirect\n0.124450 0.625184 0.625184 Ba\n0.625184 0.625184 0.625184 Ba\n0.625184 0.124450 0.625184 Ba\n0.625184 0.625184 0.124450 Ba\n0.250000 0.250000 0.250000 Ti\n0.000000 0.000000 0.000000 V\n",
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{
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"created_at": "2022-09-04T14:35:57.582865Z",
"updated_at": "2022-09-04T14:35:57.582885Z",
"structure_string": "As1 P2 Pd1\n1.0\n-0.000000 3.188364 3.188364\n3.188364 -0.000000 3.188364\n3.188364 3.188364 0.000000\nAs P Pd\n1 2 1\ndirect\n0.499999 0.499999 0.499999 As\n0.000000 0.000000 0.000000 P\n0.749999 0.749999 0.749999 P\n0.250000 0.250000 0.250000 Pd\n",
"nsites": 4,
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"spacegroup": 216
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{
"id": "jvasp-66061",
"created_at": "2022-09-04T14:35:57.587607Z",
"updated_at": "2022-09-04T14:35:57.587647Z",
"structure_string": "Ba4 Pt1 W1\n1.0\n-0.000000 4.724887 4.724887\n4.724887 0.000000 4.724887\n4.724887 4.724887 -0.000000\nBa Pt W\n4 1 1\ndirect\n0.126245 0.624586 0.624586 Ba\n0.624586 0.624586 0.624586 Ba\n0.624586 0.126245 0.624586 Ba\n0.624586 0.624586 0.126245 Ba\n0.250000 0.250000 0.250000 Pt\n0.000000 0.000000 0.000000 W\n",
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{
"id": "jvasp-64334",
"created_at": "2022-09-04T14:35:57.619527Z",
"updated_at": "2022-09-04T14:35:57.619549Z",
"structure_string": "Ba1 Ca1 Br1\n1.0\n0.000000 4.185483 4.185483\n4.185483 -0.000000 4.185483\n4.185483 4.185483 -0.000000\nBa Ca Br\n1 1 1\ndirect\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Ca\n0.000000 0.000000 0.000000 Br\n",
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{
"id": "jvasp-70147",
"created_at": "2022-09-04T14:35:57.664798Z",
"updated_at": "2022-09-04T14:35:57.664825Z",
"structure_string": "Ti1 Be2 Zn1\n1.0\n-2.039080 2.039080 2.886099\n2.039080 -2.039080 2.886099\n2.039080 2.039080 -2.886099\nTi Be Zn\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Ti\n0.000000 0.000000 0.000000 Be\n0.250000 0.750000 0.500000 Be\n0.750000 0.250000 0.500000 Zn\n",
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{
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"updated_at": "2022-09-04T14:35:57.778950Z",
"structure_string": "Sr4 Zr1 Be1\n1.0\n0.000000 4.863352 4.863352\n4.863352 0.000000 4.863352\n4.863352 4.863352 -0.000000\nSr Zr Be\n4 1 1\ndirect\n0.126107 0.624631 0.624631 Sr\n0.624631 0.624631 0.624631 Sr\n0.624631 0.126107 0.624631 Sr\n0.624631 0.624631 0.126107 Sr\n0.250000 0.250000 0.250000 Zr\n0.000000 0.000000 0.000000 Be\n",
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{
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"created_at": "2022-09-04T14:35:57.721434Z",
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"structure_string": "Ba4 Re1 Ge1\n1.0\n-0.000000 4.737650 4.737650\n4.737650 0.000000 4.737650\n4.737650 4.737650 0.000000\nBa Re Ge\n4 1 1\ndirect\n0.123863 0.625379 0.625379 Ba\n0.625379 0.625379 0.625379 Ba\n0.625379 0.123863 0.625379 Ba\n0.625379 0.625379 0.123863 Ba\n0.000000 0.000000 0.000000 Re\n0.250000 0.250000 0.250000 Ge\n",
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