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{
"id": "jvasp-67832",
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"updated_at": "2022-09-04T14:36:10.833487Z",
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{
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"structure_string": "Be1 Ga4 Pt1\n1.0\n-0.000000 3.700841 3.700841\n3.700841 -0.000000 3.700841\n3.700841 3.700841 0.000000\nBe Ga Pt\n1 4 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.125283 0.624906 0.624906 Ga\n0.624906 0.624906 0.624906 Ga\n0.624906 0.125283 0.624906 Ga\n0.624906 0.624906 0.125283 Ga\n0.250000 0.250000 0.250000 Pt\n",
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{
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"updated_at": "2022-09-04T14:36:10.084393Z",
"structure_string": "Be1 Ga1 Pt1\n1.0\n-1.572906 1.572906 4.000154\n1.572906 -1.572906 4.000154\n1.572906 1.572906 -4.000154\nBe Ga Pt\n1 1 1\ndirect\n0.011969 0.011969 0.000000 Be\n0.336068 0.336068 0.000000 Ga\n0.651962 0.651962 0.000000 Pt\n",
"nsites": 3,
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"elements": [
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"chemical_system": "Be-Ga-Pt",
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"volume": 39.58605656187946,
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"formula_full": "Be1 Ga1 Pt1",
"formula_reduced": "BeGaPt",
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"spacegroup": 107
},
{
"id": "jvasp-71501",
"created_at": "2022-09-04T14:35:52.779162Z",
"updated_at": "2022-09-04T14:35:52.779191Z",
"structure_string": "Be2 Ga1 Pt1\n1.0\n3.069944 0.000000 0.000000\n0.000000 3.069944 -0.000000\n0.000000 -0.000000 5.134531\nBe Ga Pt\n2 1 1\ndirect\n0.000000 0.000000 0.231280 Be\n0.000000 0.000000 0.768720 Be\n0.499999 0.499999 0.500000 Ga\n0.499999 0.499999 0.000000 Pt\n",
"nsites": 4,
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"elements": [
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],
"chemical_system": "Be-Ga-Pt",
"density": 9.705434396258198,
"density_atomic": 0.08266055258484088,
"volume": 48.39067578086285,
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"formula_full": "Be2 Ga1 Pt1",
"formula_reduced": "Be2GaPt",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.39109898125,
"spacegroup": 123
},
{
"id": "jvasp-71148",
"created_at": "2022-09-04T14:36:09.074492Z",
"updated_at": "2022-09-04T14:36:09.074525Z",
"structure_string": "Be1 Ga1 Pt2\n1.0\n3.158687 0.000000 0.000000\n0.000000 3.158687 0.000000\n-0.000000 0.000000 5.659896\nBe Ga Pt\n1 1 2\ndirect\n0.000000 0.000000 0.459120 Be\n0.500000 0.500000 0.754786 Ga\n0.000000 0.000000 0.968341 Pt\n0.500000 0.500000 0.317756 Pt\n",
"nsites": 4,
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"elements": [
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],
"chemical_system": "Be-Ga-Pt",
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"density_atomic": 0.070833443342659,
"volume": 56.47050053249389,
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"formula_full": "Be1 Ga1 Pt2",
"formula_reduced": "BeGaPt2",
"formula_anonymous": "ABC2",
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"spacegroup": 99
},
{
"id": "jvasp-74506",
"created_at": "2022-09-04T14:36:21.021804Z",
"updated_at": "2022-09-04T14:36:21.021824Z",
"structure_string": "Be2 Ga1 Pd1\n1.0\n3.034439 0.000000 0.000000\n0.000000 3.034439 -0.000000\n0.000000 0.000000 5.168450\nBe Ga Pd\n2 1 1\ndirect\n0.000000 0.000000 0.011068 Be\n0.500000 0.500000 0.228539 Be\n0.000000 0.000000 0.477960 Ga\n0.500000 0.500000 0.782434 Pd\n",
"nsites": 4,
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"elements": [
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],
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"volume": 47.590157510138255,
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"formula_full": "Be2 Ga1 Pd1",
"formula_reduced": "Be2GaPd",
"formula_anonymous": "ABC2",
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"spacegroup": 99
},
{
"id": "jvasp-69482",
"created_at": "2022-09-04T14:36:13.623235Z",
"updated_at": "2022-09-04T14:36:13.623271Z",
"structure_string": "Be1 Ga2 Pd2\n1.0\n-1.749938 1.749938 6.412166\n1.749938 -1.749938 6.412166\n1.749938 1.749938 -6.412166\nBe Ga Pd\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Be\n0.750001 0.250000 0.500000 Ga\n0.250000 0.750001 0.500000 Ga\n0.601163 0.601163 0.000000 Pd\n0.398837 0.398837 0.000000 Pd\n",
"nsites": 5,
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"elements": [
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"volume": 78.54346783850546,
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"formula_full": "Be1 Ga2 Pd2",
"formula_reduced": "Be(GaPd)2",
"formula_anonymous": "AB2C2",
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"spacegroup": 139
},
{
"id": "jvasp-71405",
"created_at": "2022-09-04T14:35:57.895603Z",
"updated_at": "2022-09-04T14:35:57.895633Z",
"structure_string": "Be1 Ga1 Pd1\n1.0\n1.429646 -2.476219 -0.000000\n1.429646 2.476219 0.000000\n-0.000000 0.000000 5.793137\nBe Ga Pd\n1 1 1\ndirect\n0.000000 0.000000 0.016858 Be\n0.666669 0.333334 0.677138 Ga\n0.333334 0.666669 0.306005 Pd\n",
"nsites": 3,
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"volume": 41.016760786005,
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"formula_full": "Be1 Ga1 Pd1",
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"formula_anonymous": "ABC",
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"spacegroup": 156
},
{
"id": "jvasp-64951",
"created_at": "2022-09-04T14:38:07.122361Z",
"updated_at": "2022-09-04T14:38:07.122391Z",
"structure_string": "Be1 Ga4 Pd1\n1.0\n-0.000000 3.698980 3.698980\n3.698980 0.000000 3.698980\n3.698980 3.698980 -0.000000\nBe Ga Pd\n1 4 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.375013 0.375013 0.375013 Ga\n0.375013 0.874961 0.375013 Ga\n0.375013 0.375013 0.874961 Ga\n0.874961 0.375013 0.375013 Ga\n0.750000 0.750000 0.750000 Pd\n",
"nsites": 6,
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"elements": [
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"formula_full": "Be1 Ga4 Pd1",
"formula_reduced": "BeGa4Pd",
"formula_anonymous": "ABC4",
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"spacegroup": 216
},
{
"id": "jvasp-70283",
"created_at": "2022-09-04T14:36:07.531240Z",
"updated_at": "2022-09-04T14:36:07.531265Z",
"structure_string": "Be2 Ga1 Pd1\n1.0\n-1.773703 1.773703 3.722293\n1.773703 -1.773703 3.722293\n1.773703 1.773703 -3.722293\nBe Ga Pd\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.749999 0.499999 Be\n0.500000 0.500000 0.000000 Ga\n0.749999 0.250000 0.499999 Pd\n",
"nsites": 4,
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"elements": [
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"spacegroup": 119
},
{
"id": "jvasp-81882",
"created_at": "2022-09-04T14:37:04.014249Z",
"updated_at": "2022-09-04T14:37:04.014277Z",
"structure_string": "Be1 Ga1 Pd2\n1.0\n-9.996206 1.838238 -0.649697\n-7.609581 0.178702 1.750830\n-5.913401 3.565806 -0.543992\nBe Ga Pd\n1 1 2\ndirect\n-0.000049 0.000026 0.000049 Be\n0.500012 -0.000007 -0.000011 Ga\n0.719324 0.062565 -0.000925 Pd\n0.280717 0.937414 0.000885 Pd\n",
"nsites": 4,
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"formula_full": "Be1 Ga1 Pd2",
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},
{
"id": "jvasp-69820",
"created_at": "2022-09-04T14:36:12.096499Z",
"updated_at": "2022-09-04T14:36:12.096526Z",
"structure_string": "Be2 Ga1 Pb1\n1.0\n-1.888877 1.888877 4.837101\n1.888877 -1.888877 4.837101\n1.888877 1.888877 -4.837101\nBe Ga Pb\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.750001 0.500001 Be\n0.500000 0.500000 0.000000 Ga\n0.750001 0.250000 0.500001 Pb\n",
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}