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{
"id": "jvasp-7743",
"created_at": "2022-09-04T14:36:48.448673Z",
"updated_at": "2022-09-04T14:36:48.448684Z",
"structure_string": "Mo6 Pt2\n1.0\n5.013185 0.000000 -0.000000\n-0.000000 5.013185 -0.000000\n-0.000000 -0.000000 5.013185\nMo Pt\n6 2\ndirect\n0.250000 0.000000 0.500000 Mo\n0.750001 0.000000 0.500000 Mo\n0.000000 0.500000 0.250000 Mo\n0.000000 0.500000 0.750001 Mo\n0.500000 0.750001 0.000000 Mo\n0.500000 0.250000 0.000000 Mo\n0.000000 0.000000 0.000000 Pt\n0.500000 0.500000 0.500000 Pt\n",
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{
"id": "jvasp-37176",
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"structure_string": "Mo2 Pt2\n1.0\n2.754652 0.000000 0.000000\n0.000000 4.505236 -0.000000\n0.000000 0.000000 4.972686\nMo Pt\n2 2\ndirect\n0.000000 0.750001 0.163115 Mo\n0.000000 0.250000 0.836886 Mo\n0.500000 0.750001 0.665072 Pt\n0.500000 0.250000 0.334928 Pt\n",
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"volume": 61.71281028848709,
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{
"id": "jvasp-19912",
"created_at": "2022-09-04T14:37:01.415222Z",
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"structure_string": "Mo1 Pt2\n1.0\n2.665086 -0.000000 -0.802949\n-0.492470 3.592206 -1.634572\n0.004573 0.001020 4.839528\nMo Pt\n1 2\ndirect\n0.000000 0.000000 0.000000 Mo\n0.663095 0.663095 0.326190 Pt\n0.336905 0.336906 0.673811 Pt\n",
"nsites": 3,
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"elements": [
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"density": 17.415556573628727,
"density_atomic": 0.0647256986943515,
"volume": 46.34944172895896,
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"spacegroup": 71
},
{
"id": "jvasp-99953",
"created_at": "2022-09-04T14:36:31.900512Z",
"updated_at": "2022-09-04T14:36:31.900539Z",
"structure_string": "Mo1 Pt3\n1.0\n2.792832 0.000000 0.000000\n0.000000 4.563856 0.000000\n0.000000 0.000000 4.898377\nMo Pt\n1 3\ndirect\n0.000000 0.000000 0.157364 Mo\n0.500000 0.500000 0.338784 Pt\n0.500000 0.000000 0.656080 Pt\n0.000000 0.500000 0.847773 Pt\n",
"nsites": 4,
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"elements": [
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"density": 18.117141830273045,
"density_atomic": 0.06406650595338308,
"volume": 62.43512020010165,
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"formula_full": "Mo1 Pt3",
"formula_reduced": "MoPt3",
"formula_anonymous": "AB3",
"energy_above_hull": 3.415382525,
"spacegroup": 25
},
{
"id": "jvasp-102331",
"created_at": "2022-09-04T14:36:34.970106Z",
"updated_at": "2022-09-04T14:36:34.970130Z",
"structure_string": "Mo1 Pt1\n1.0\n2.812373 0.000000 0.000000\n-1.406187 2.435586 0.000000\n0.000000 0.000000 4.540236\nMo Pt\n1 1\ndirect\n0.666666 0.333334 -0.000000 Mo\n0.333333 0.666668 0.500000 Pt\n",
"nsites": 2,
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"elements": [
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"chemical_system": "Mo-Pt",
"density": 15.539000700167886,
"density_atomic": 0.06430950678877903,
"volume": 31.099600974532237,
"volume_molar": 9.364308732423314,
"formula_full": "Mo1 Pt1",
"formula_reduced": "MoPt",
"formula_anonymous": "AB",
"energy_above_hull": 2.7764486499999994,
"spacegroup": 187
},
{
"id": "jvasp-17168",
"created_at": "2022-09-04T14:37:39.437675Z",
"updated_at": "2022-09-04T14:37:39.437704Z",
"structure_string": "Mo1 Pt3\n1.0\n3.973579 -0.000000 0.000000\n-0.000000 3.973579 0.000000\n-0.000000 -0.000000 3.973579\nMo Pt\n1 3\ndirect\n0.000000 0.000000 0.000000 Mo\n0.500000 0.500000 0.000000 Pt\n0.500000 0.000000 0.500000 Pt\n0.000000 0.500000 0.500000 Pt\n",
"nsites": 4,
"nelements": 2,
"elements": [
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"density": 18.029059874330116,
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"volume": 62.74015038720459,
"volume_molar": 9.445750423382863,
"formula_full": "Mo1 Pt3",
"formula_reduced": "MoPt3",
"formula_anonymous": "AB3",
"energy_above_hull": 3.428187525,
"spacegroup": 221
},
{
"id": "jvasp-102193",
"created_at": "2022-09-04T14:36:45.748951Z",
"updated_at": "2022-09-04T14:36:45.748968Z",
"structure_string": "Mo1 Pd1\n1.0\n2.656554 0.001622 4.125476\n1.214588 2.362638 4.125476\n0.002656 0.001622 4.906814\nMo Pd\n1 1\ndirect\n0.000000 0.000000 0.000000 Mo\n0.500001 0.499999 0.500000 Pd\n",
"nsites": 2,
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"elements": [
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],
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"volume": 30.752311557843296,
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"formula_full": "Mo1 Pd1",
"formula_reduced": "MoPd",
"formula_anonymous": "AB",
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"spacegroup": 166
},
{
"id": "jvasp-108749",
"created_at": "2022-09-04T14:38:10.533946Z",
"updated_at": "2022-09-04T14:38:10.533975Z",
"structure_string": "Mo1 Pd4\n1.0\n2.765218 0.001792 11.168278\n1.363559 2.405647 11.168278\n0.003073 0.001792 11.505514\nMo Pd\n1 4\ndirect\n0.000000 0.000000 0.000000 Mo\n0.601667 0.601667 0.601667 Pd\n0.200422 0.200422 0.200422 Pd\n0.799578 0.799578 0.799578 Pd\n0.398333 0.398333 0.398333 Pd\n",
"nsites": 5,
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"elements": [
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"volume": 76.39760486697679,
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"formula_full": "Mo1 Pd4",
"formula_reduced": "MoPd4",
"formula_anonymous": "AB4",
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"spacegroup": 166
},
{
"id": "jvasp-110007",
"created_at": "2022-09-04T14:38:04.825784Z",
"updated_at": "2022-09-04T14:38:04.825811Z",
"structure_string": "Mo3 Pd1\n1.0\n3.957152 -0.000000 0.000000\n0.000000 3.957152 0.000000\n-0.000000 0.000000 3.957152\nMo Pd\n3 1\ndirect\n-0.000000 0.500000 0.500000 Mo\n0.500000 0.500000 -0.000000 Mo\n0.500000 0.000000 0.500000 Mo\n0.000000 0.000000 0.000000 Pd\n",
"nsites": 4,
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"elements": [
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"formula_full": "Mo3 Pd1",
"formula_reduced": "Mo3Pd",
"formula_anonymous": "AB3",
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"spacegroup": 221
},
{
"id": "jvasp-79552",
"created_at": "2022-09-04T14:37:58.755148Z",
"updated_at": "2022-09-04T14:37:58.755171Z",
"structure_string": "Mo2 Pb2\n1.0\n4.264966 -0.000000 0.000000\n-0.000000 4.264966 0.000000\n-2.132483 -2.132483 4.486092\nMo Pb\n2 2\ndirect\n0.250001 0.750001 0.500000 Mo\n0.000000 0.000000 0.000000 Mo\n0.750001 0.250001 0.500000 Pb\n0.500000 0.500000 -0.000000 Pb\n",
"nsites": 4,
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"elements": [
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"density": 12.337382142157358,
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"volume": 81.6017217994841,
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"formula_full": "Mo2 Pb2",
"formula_reduced": "MoPb",
"formula_anonymous": "AB",
"energy_above_hull": 2.5649333599999995,
"spacegroup": 141
},
{
"id": "jvasp-21565",
"created_at": "2022-09-04T14:37:32.300209Z",
"updated_at": "2022-09-04T14:37:32.300233Z",
"structure_string": "Mo12 P4\n1.0\n4.580223 -0.000000 1.596206\n2.290111 6.972674 0.798102\n-0.004512 -0.000000 7.382394\nMo P\n12 4\ndirect\n0.467688 0.000000 0.598016 Mo\n0.934296 0.598016 0.000001 Mo\n0.532312 0.401983 0.000000 Mo\n0.065704 0.000000 0.401984 Mo\n0.354338 0.645661 0.645661 Mo\n0.000000 0.645661 0.354338 Mo\n0.000000 0.354338 0.645661 Mo\n0.645661 0.354338 0.354338 Mo\n0.675899 0.000000 0.184771 Mo\n0.139330 0.184770 0.000000 Mo\n0.324100 0.815229 0.000000 Mo\n0.860669 0.000000 0.815230 Mo\n0.208254 0.291746 0.291746 P\n0.500000 0.291746 0.708254 P\n0.500000 0.708253 0.291746 P\n0.791746 0.708253 0.708254 P\n",
"nsites": 16,
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"elements": [
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"density": 8.979314975778223,
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},
{
"id": "jvasp-35991",
"created_at": "2022-09-04T14:37:28.393391Z",
"updated_at": "2022-09-04T14:37:28.393418Z",
"structure_string": "Mo1 P1\n1.0\n2.712399 2.712399 0.000000\n2.712399 -0.000000 -2.712399\n0.000000 2.712399 -2.712399\nMo P\n1 1\ndirect\n0.000000 0.000000 0.000000 Mo\n0.750000 0.750000 0.750000 P\n",
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"elements": [
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