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{
"id": "mp-1183335",
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"structure_string": "Ba1 Sr3\n1.0\n-3.073705 3.073705 6.084855\n3.073705 -3.073705 6.084855\n3.073705 3.073705 -6.084855\nBa Sr\n1 3\ndirect\n0.000000 0.000000 0.000000 Ba\n0.750000 0.250000 0.500000 Sr\n0.250000 0.750000 0.500000 Sr\n0.500000 0.500000 0.000000 Sr\n",
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{
"id": "mp-571386",
"created_at": "2022-09-04T14:47:02.298162Z",
"structure_string": "Cu1 Cl1\n1.0\n0.000000 2.555898 2.555898\n2.555898 0.000000 2.555898\n2.555898 2.555898 0.000000\nCu Cl\n1 1\ndirect\n0.000000 0.000000 0.000000 Cu\n0.500000 0.500000 0.500000 Cl\n",
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"elements": [
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"updated_at": "2021-11-28T01:37:55.175000Z",
"spacegroup": 225
},
{
"id": "mp-1183587",
"created_at": "2022-09-04T14:47:07.445880Z",
"structure_string": "Cd3 As1\n1.0\n-2.262266 2.262266 4.364764\n2.262266 -2.262266 4.364764\n2.262266 2.262266 -4.364764\nCd As\n3 1\ndirect\n0.750000 0.250000 0.500000 Cd\n0.250000 0.750000 0.500000 Cd\n0.500000 0.500000 0.000000 Cd\n0.000000 0.000000 0.000000 As\n",
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"elements": [
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{
"id": "mp-1009547",
"created_at": "2022-09-04T14:41:22.573432Z",
"structure_string": "Cs1 Rb1 As1\n1.0\n0.000000 4.273680 4.273680\n4.273680 0.000000 4.273680\n4.273680 4.273680 0.000000\nCs Rb As\n1 1 1\ndirect\n0.500000 0.500000 0.500000 Cs\n0.000000 0.000000 0.000000 Rb\n0.750000 0.750000 0.750000 As\n",
"nsites": 3,
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"elements": [
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"volume": 156.11189548796003,
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"formula_full": "Cs1 Rb1 As1",
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"spacegroup": 216
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{
"id": "mp-1062935",
"created_at": "2022-09-04T14:46:32.712538Z",
"structure_string": "La1 Hg2\n1.0\n2.578425 -4.465963 0.000000\n2.578425 4.465963 0.000000\n0.000000 0.000000 3.510065\nLa Hg\n1 2\ndirect\n0.000000 0.000000 0.000000 La\n0.666667 0.333333 0.520587 Hg\n0.333333 0.666667 0.479413 Hg\n",
"nsites": 3,
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"elements": [
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"volume": 80.83785452047479,
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"formula_full": "La1 Hg2",
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"updated_at": "2021-11-28T01:37:43.194000Z",
"spacegroup": 164
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{
"id": "mp-11463",
"created_at": "2022-09-04T14:47:38.319134Z",
"structure_string": "La1 Hg2\n1.0\n2.556646 -4.428241 0.000000\n2.556646 4.428241 0.000000\n0.000000 0.000000 3.596537\nLa Hg\n1 2\ndirect\n0.000000 0.000000 0.000000 La\n0.666667 0.333333 0.500000 Hg\n0.333333 0.666667 0.500000 Hg\n",
"nsites": 3,
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"elements": [
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"density": 11.012735675810227,
"density_atomic": 0.03683874947533125,
"volume": 81.43598908016473,
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"formula_full": "La1 Hg2",
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"energy": -6.987509449999999,
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"updated_at": "2021-11-28T01:38:14.504000Z",
"spacegroup": 191
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{
"id": "mp-984784",
"created_at": "2022-09-04T14:46:33.762779Z",
"structure_string": "Ba2 Zn1 Cd1\n1.0\n0.000000 4.220363 4.220363\n4.220363 0.000000 4.220363\n4.220363 4.220363 0.000000\nBa Zn Cd\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 Ba\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.500000 Cd\n",
"nsites": 4,
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"elements": [
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"density": 4.9976209090964305,
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"volume": 150.34168603168672,
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"formula_full": "Ba2 Zn1 Cd1",
"formula_reduced": "Ba2ZnCd",
"formula_anonymous": "ABC2",
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{
"id": "mp-1186129",
"created_at": "2022-09-04T14:42:11.524455Z",
"structure_string": "Na1 Ca3\n1.0\n0.000000 4.337326 4.337326\n4.337326 0.000000 4.337326\n4.337326 4.337326 0.000000\nNa Ca\n1 3\ndirect\n0.000000 0.000000 0.000000 Na\n0.250000 0.250000 0.250000 Ca\n0.750000 0.750000 0.750000 Ca\n0.500000 0.500000 0.500000 Ca\n",
"nsites": 4,
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"elements": [
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"volume": 163.19099578854738,
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"formula_full": "Na1 Ca3",
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{
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"created_at": "2022-09-04T14:42:58.733239Z",
"structure_string": "Na3 Al1\n1.0\n0.000000 3.833004 3.833004\n3.833004 0.000000 3.833004\n3.833004 3.833004 0.000000\nNa Al\n3 1\ndirect\n0.250000 0.250000 0.250000 Na\n0.750000 0.750000 0.750000 Na\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Al\n",
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{
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"created_at": "2022-09-04T14:48:21.409481Z",
"structure_string": "Ca1 Mg3\n1.0\n0.000000 3.745744 3.745744\n3.745744 0.000000 3.745744\n3.745744 3.745744 0.000000\nCa Mg\n1 3\ndirect\n0.500000 0.500000 0.500000 Ca\n0.000000 0.000000 0.000000 Mg\n0.250000 0.250000 0.250000 Mg\n0.750000 0.750000 0.750000 Mg\n",
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{
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"structure_string": "K2 Pd1\n1.0\n5.667087 0.000000 0.000000\n0.000000 5.667087 0.000000\n0.000000 0.000000 3.665316\nK Pd\n2 1\ndirect\n0.000000 0.500000 0.500000 K\n0.500000 0.000000 0.500000 K\n0.000000 0.000000 0.000000 Pd\n",
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}