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{
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"results": [
{
"id": "mp-16522",
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"structure_string": "Al2 Pd1\n1.0\n0.000000 2.972242 2.972242\n2.972242 0.000000 2.972242\n2.972242 2.972242 0.000000\nAl Pd\n2 1\ndirect\n0.250000 0.250000 0.250000 Al\n0.750000 0.750000 0.750000 Al\n0.000000 0.000000 0.000000 Pd\n",
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{
"id": "mp-16523",
"created_at": "2022-09-04T14:41:44.995418Z",
"structure_string": "Al6 Pd10\n1.0\n4.074880 0.000000 0.000000\n0.000000 5.446143 0.000000\n0.000000 0.000000 10.650034\nAl Pd\n6 10\ndirect\n0.000000 0.000000 0.000000 Al\n0.000000 0.500000 0.500000 Al\n0.500000 0.160877 0.356912 Al\n0.500000 0.839123 0.643088 Al\n0.500000 0.660877 0.143088 Al\n0.500000 0.339123 0.856912 Al\n0.500000 0.186730 0.105519 Pd\n0.500000 0.813270 0.894481 Pd\n0.500000 0.686730 0.394481 Pd\n0.500000 0.313270 0.605519 Pd\n0.000000 0.000000 0.500000 Pd\n0.000000 0.500000 0.000000 Pd\n0.000000 0.903599 0.232236 Pd\n0.000000 0.096401 0.767764 Pd\n0.000000 0.403599 0.267764 Pd\n0.000000 0.596401 0.732236 Pd\n",
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},
{
"id": "mp-605663",
"created_at": "2022-09-04T14:43:17.551604Z",
"structure_string": "Al4 Pd20\n1.0\n4.066711 0.000000 0.000000\n0.000000 8.215777 0.000000\n0.000000 0.000000 10.895022\nAl Pd\n4 20\ndirect\n0.750000 0.112019 0.921627 Al\n0.250000 0.612019 0.578373 Al\n0.250000 0.887981 0.078373 Al\n0.750000 0.387981 0.421627 Al\n0.250000 0.218946 0.042519 Pd\n0.750000 0.714300 0.203536 Pd\n0.250000 0.543897 0.335926 Pd\n0.750000 0.456103 0.664074 Pd\n0.250000 0.956103 0.835926 Pd\n0.250000 0.285700 0.796464 Pd\n0.750000 0.718946 0.457481 Pd\n0.250000 0.572067 0.070255 Pd\n0.250000 0.927933 0.570255 Pd\n0.750000 0.785700 0.703536 Pd\n0.750000 0.384134 0.184251 Pd\n0.750000 0.072067 0.429745 Pd\n0.250000 0.281054 0.542519 Pd\n0.750000 0.781054 0.957481 Pd\n0.250000 0.214300 0.296464 Pd\n0.750000 0.043897 0.164074 Pd\n0.250000 0.615866 0.815749 Pd\n0.750000 0.427933 0.929745 Pd\n0.250000 0.884134 0.315749 Pd\n0.750000 0.115866 0.684251 Pd\n",
"nsites": 24,
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"elements": [
"Al",
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"density": 10.201503331845498,
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"volume": 364.01565771667043,
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"formula_full": "Al4 Pd20",
"formula_reduced": "AlPd5",
"formula_anonymous": "AB5",
"energy": -129.68461687,
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"updated_at": "2021-11-28T01:36:03.513000Z",
"spacegroup": 62
},
{
"id": "mp-1183143",
"created_at": "2022-09-04T14:44:19.881065Z",
"structure_string": "Al1 Pd3\n1.0\n3.909386 0.000000 0.000000\n0.000000 3.909386 0.000000\n0.000000 0.000000 3.909386\nAl Pd\n1 3\ndirect\n0.000000 0.000000 0.000000 Al\n0.000000 0.500000 0.500000 Pd\n0.500000 0.000000 0.500000 Pd\n0.500000 0.500000 0.000000 Pd\n",
"nsites": 4,
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"volume": 59.748314741731605,
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"formula_full": "Al1 Pd3",
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"spacegroup": 221
},
{
"id": "mp-669546",
"created_at": "2022-09-04T14:41:09.456439Z",
"structure_string": "Al13 Pd13\n1.0\n4.887645 -7.890397 0.000000\n4.887645 7.890397 0.000000\n-7.850260 0.000000 4.951853\nAl Pd\n13 13\ndirect\n0.097950 0.346031 0.054748 Al\n0.155460 0.753118 0.598540 Al\n0.598540 0.155460 0.753118 Al\n0.844540 0.246882 0.401460 Al\n0.401460 0.844540 0.246882 Al\n0.346031 0.054748 0.097950 Al\n0.945252 0.902050 0.653969 Al\n0.246882 0.401460 0.844540 Al\n0.653969 0.945252 0.902050 Al\n0.753118 0.598540 0.155460 Al\n0.054748 0.097950 0.346031 Al\n0.500000 0.500000 0.500000 Al\n0.902050 0.653969 0.945252 Al\n0.554375 0.597354 0.843733 Pd\n0.445625 0.402646 0.156267 Pd\n0.098782 0.655351 0.251924 Pd\n0.748076 0.901218 0.344649 Pd\n0.251924 0.098782 0.655351 Pd\n0.901218 0.344649 0.748076 Pd\n0.402646 0.156267 0.445625 Pd\n0.156267 0.445625 0.402646 Pd\n0.655351 0.251924 0.098782 Pd\n0.344649 0.748076 0.901218 Pd\n0.843733 0.554375 0.597354 Pd\n0.000000 0.000000 0.000000 Pd\n0.597354 0.843733 0.554375 Pd\n",
"nsites": 26,
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"elements": [
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"density": 7.539751619846484,
"density_atomic": 0.06807334614331756,
"volume": 381.94097209884694,
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"formula_full": "Al13 Pd13",
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"energy": -139.55633357,
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"updated_at": "2021-11-28T01:35:09.259000Z",
"spacegroup": 148
},
{
"id": "mp-1215027",
"created_at": "2022-09-04T14:44:52.988316Z",
"structure_string": "Al84 Pt20\n1.0\n0.000000 9.453615 9.453615\n9.453615 0.000000 9.453615\n9.453615 9.453615 0.000000\nAl Pt\n84 20\ndirect\n0.252438 0.252438 0.915935 Al\n0.252438 0.252438 0.579190 Al\n0.915935 0.579190 0.252438 Al\n0.915935 0.252438 0.252438 Al\n0.579190 0.915935 0.252438 Al\n0.579190 0.252438 0.252438 Al\n0.252438 0.915935 0.579190 Al\n0.252438 0.579190 0.915935 Al\n0.252438 0.915935 0.252438 Al\n0.579190 0.252438 0.915935 Al\n0.915935 0.252438 0.579190 Al\n0.252438 0.579190 0.252438 Al\n0.171847 0.171847 0.171847 Al\n0.171847 0.171847 0.484459 Al\n0.171847 0.484459 0.171847 Al\n0.484459 0.171847 0.171847 Al\n0.802640 0.802640 0.802640 Al\n0.802640 0.802640 0.592081 Al\n0.802640 0.592081 0.802640 Al\n0.592081 0.802640 0.802640 Al\n0.053212 0.053212 0.053212 Al\n0.053212 0.053212 0.840364 Al\n0.053212 0.840364 0.053212 Al\n0.840364 0.053212 0.053212 Al\n0.507890 0.507890 0.803990 Al\n0.507890 0.507890 0.180229 Al\n0.803990 0.180229 0.507890 Al\n0.803990 0.507890 0.507890 Al\n0.180229 0.803990 0.507890 Al\n0.180229 0.507890 0.507890 Al\n0.507890 0.803990 0.180229 Al\n0.507890 0.180229 0.803990 Al\n0.507890 0.803990 0.507890 Al\n0.180229 0.507890 0.803990 Al\n0.803990 0.507890 0.180229 Al\n0.507890 0.180229 0.507890 Al\n0.906251 0.906251 0.906251 Al\n0.906251 0.906251 0.281248 Al\n0.906251 0.281248 0.906251 Al\n0.281248 0.906251 0.906251 Al\n0.757639 0.757639 0.420182 Al\n0.757639 0.757639 0.064540 Al\n0.420182 0.064540 0.757639 Al\n0.420182 0.757639 0.757639 Al\n0.064540 0.420182 0.757639 Al\n0.064540 0.757639 0.757639 Al\n0.757639 0.420182 0.064540 Al\n0.757639 0.064540 0.420182 Al\n0.757639 0.420182 0.757639 Al\n0.064540 0.757639 0.420182 Al\n0.420182 0.757639 0.064540 Al\n0.757639 0.064540 0.757639 Al\n0.554441 0.554441 0.554441 Al\n0.554441 0.554441 0.336676 Al\n0.554441 0.336676 0.554441 Al\n0.336676 0.554441 0.554441 Al\n0.326939 0.326939 0.326939 Al\n0.326939 0.326939 0.019183 Al\n0.326939 0.019183 0.326939 Al\n0.019183 0.326939 0.326939 Al\n0.930325 0.569675 0.569675 Al\n0.569675 0.930325 0.930325 Al\n0.569675 0.930325 0.569675 Al\n0.930325 0.569675 0.930325 Al\n0.569675 0.569675 0.930325 Al\n0.930325 0.930325 0.569675 Al\n0.010812 0.010812 0.320219 Al\n0.010812 0.010812 0.658158 Al\n0.320219 0.658158 0.010812 Al\n0.320219 0.010812 0.010812 Al\n0.658158 0.320219 0.010812 Al\n0.658158 0.010812 0.010812 Al\n0.010812 0.320219 0.658158 Al\n0.010812 0.658158 0.320219 Al\n0.010812 0.320219 0.010812 Al\n0.658158 0.010812 0.320219 Al\n0.320219 0.010812 0.658158 Al\n0.010812 0.658158 0.010812 Al\n0.675465 0.324535 0.324535 Al\n0.324535 0.675465 0.675465 Al\n0.324535 0.675465 0.324535 Al\n0.675465 0.324535 0.675465 Al\n0.324535 0.324535 0.675465 Al\n0.675465 0.675465 0.324535 Al\n0.658068 0.658068 0.658068 Pt\n0.658068 0.658068 0.025795 Pt\n0.658068 0.025795 0.658068 Pt\n0.025795 0.658068 0.658068 Pt\n0.419567 0.419567 0.419567 Pt\n0.419567 0.419567 0.741300 Pt\n0.419567 0.741300 0.419567 Pt\n0.741300 0.419567 0.419567 Pt\n0.408305 0.091695 0.091695 Pt\n0.091695 0.408305 0.408305 Pt\n0.091695 0.408305 0.091695 Pt\n0.408305 0.091695 0.408305 Pt\n0.091695 0.091695 0.408305 Pt\n0.408305 0.408305 0.091695 Pt\n0.833783 0.166217 0.166217 Pt\n0.166217 0.833783 0.833783 Pt\n0.166217 0.833783 0.166217 Pt\n0.833783 0.166217 0.833783 Pt\n0.166217 0.166217 0.833783 Pt\n0.833783 0.833783 0.166217 Pt\n",
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{
"id": "mp-1501",
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"structure_string": "Al6 Pt10\n1.0\n4.005285 0.000000 0.000000\n0.000000 5.467908 0.000000\n0.000000 0.000000 10.893044\nAl Pt\n6 10\ndirect\n0.500000 0.181425 0.639918 Al\n0.500000 0.818575 0.360082 Al\n0.500000 0.681425 0.860082 Al\n0.500000 0.318575 0.139918 Al\n0.000000 0.500000 0.500000 Al\n0.000000 0.000000 0.000000 Al\n0.500000 0.292922 0.392753 Pt\n0.500000 0.707078 0.607247 Pt\n0.500000 0.792922 0.107247 Pt\n0.500000 0.207078 0.892753 Pt\n0.000000 0.428609 0.730918 Pt\n0.000000 0.571391 0.269082 Pt\n0.000000 0.928609 0.769082 Pt\n0.000000 0.071391 0.230918 Pt\n0.000000 0.500000 0.000000 Pt\n0.000000 0.000000 0.500000 Pt\n",
"nsites": 16,
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"elements": [
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"formula_full": "Al6 Pt10",
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"spacegroup": 55
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{
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"structure_string": "Al2 Pt1\n1.0\n0.000000 2.974377 2.974377\n2.974377 0.000000 2.974377\n2.974377 2.974377 0.000000\nAl Pt\n2 1\ndirect\n0.750000 0.750000 0.750000 Al\n0.250000 0.250000 0.250000 Al\n0.000000 0.000000 0.000000 Pt\n",
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{
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{
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"structure_string": "Al4 Pt12\n1.0\n5.518264 0.000000 0.000000\n0.000000 5.518264 0.000000\n0.000000 0.000000 7.948354\nAl Pt\n4 12\ndirect\n0.500000 0.000000 0.242066 Al\n0.000000 0.500000 0.242066 Al\n0.500000 0.000000 0.757934 Al\n0.000000 0.500000 0.757934 Al\n0.278162 0.221838 0.000000 Pt\n0.778162 0.278162 0.000000 Pt\n0.221838 0.721838 0.000000 Pt\n0.721838 0.778162 0.000000 Pt\n0.000000 0.000000 0.252158 Pt\n0.500000 0.500000 0.252158 Pt\n0.696287 0.196287 0.500000 Pt\n0.196287 0.303713 0.500000 Pt\n0.803713 0.696287 0.500000 Pt\n0.303713 0.803713 0.500000 Pt\n0.000000 0.000000 0.747842 Pt\n0.500000 0.500000 0.747842 Pt\n",
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"updated_at": "2021-11-28T01:35:40.330000Z",
"spacegroup": 127
},
{
"id": "mp-569916",
"created_at": "2022-09-04T14:40:18.711251Z",
"structure_string": "Al6 Pt4\n1.0\n2.064995 -3.576676 0.000000\n2.064995 3.576676 0.000000\n0.000000 0.000000 11.131275\nAl Pt\n6 4\ndirect\n0.333333 0.666667 0.333917 Al\n0.666667 0.333333 0.666083 Al\n0.000000 0.000000 0.500000 Al\n0.000000 0.000000 0.000000 Al\n0.000000 0.000000 0.773199 Al\n0.000000 0.000000 0.226801 Al\n0.333333 0.666667 0.587759 Pt\n0.333333 0.666667 0.103048 Pt\n0.666667 0.333333 0.412241 Pt\n0.666667 0.333333 0.896952 Pt\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Al",
"Pt"
],
"chemical_system": "Al-Pt",
"density": 9.515471537568265,
"density_atomic": 0.06081720919265244,
"volume": 164.42714377640561,
"volume_molar": 9.902034045862727,
"formula_full": "Al6 Pt4",
"formula_reduced": "Al3Pt2",
"formula_anonymous": "A2B3",
"energy": -53.14298805,
"energy_per_atom": -5.314298805,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
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"updated_at": "2021-11-28T01:34:51.769000Z",
"spacegroup": 164
},
{
"id": "mp-1182870",
"created_at": "2022-09-04T14:44:23.159110Z",
"structure_string": "Al4 Pt12\n1.0\n6.578427 0.000000 0.000000\n0.000000 6.578427 0.000000\n0.000000 0.000000 5.760983\nAl Pt\n4 12\ndirect\n0.000000 0.500000 0.244905 Al\n0.500000 0.000000 0.755095 Al\n0.500000 0.000000 0.244905 Al\n0.000000 0.500000 0.755095 Al\n0.736823 0.236823 0.000000 Pt\n0.000000 0.000000 0.251129 Pt\n0.222211 0.722211 0.500000 Pt\n0.277789 0.222211 0.500000 Pt\n0.263177 0.763177 0.000000 Pt\n0.722211 0.777789 0.500000 Pt\n0.777789 0.277789 0.500000 Pt\n0.763177 0.736823 0.000000 Pt\n0.500000 0.500000 0.251129 Pt\n0.000000 0.000000 0.748871 Pt\n0.236823 0.263177 0.000000 Pt\n0.500000 0.500000 0.748871 Pt\n",
"nsites": 16,
"nelements": 2,
"elements": [
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"Pt"
],
"chemical_system": "Al-Pt",
"density": 16.311184212790767,
"density_atomic": 0.06417697896804596,
"volume": 249.31058235019884,
"volume_molar": 9.38364637419043,
"formula_full": "Al4 Pt12",
"formula_reduced": "AlPt3",
"formula_anonymous": "AB3",
"energy": -95.96887727,
"energy_per_atom": -5.998054829375,
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"total_magnetization": 0.000136,
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"updated_at": "2021-11-28T01:36:33.476000Z",
"spacegroup": 127
}
]
}