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{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-elements&page=3819",
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"results": [
{
"id": "jvasp-18942",
"created_at": "2022-09-04T14:37:07.996793Z",
"updated_at": "2022-09-04T14:37:07.996808Z",
"structure_string": "Si4 Pt4\n1.0\n3.653857 0.000000 0.000000\n-0.000000 5.713382 0.000000\n0.000000 0.000000 5.985556\nSi Pt\n4 4\ndirect\n0.250000 0.679864 0.084340 Si\n0.750001 0.320136 0.915661 Si\n0.250000 0.179864 0.415660 Si\n0.750001 0.820136 0.584340 Si\n0.250000 0.490477 0.694697 Pt\n0.750001 0.509523 0.305304 Pt\n0.250000 0.990477 0.805304 Pt\n0.750001 0.009523 0.194696 Pt\n",
"nsites": 8,
"nelements": 2,
"elements": [
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"density": 11.863002506376532,
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"volume": 124.95375366376118,
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"formula_full": "Si4 Pt4",
"formula_reduced": "SiPt",
"formula_anonymous": "AB",
"energy_above_hull": 1.6235749999999998,
"spacegroup": 62
},
{
"id": "jvasp-35269",
"created_at": "2022-09-04T14:37:29.512648Z",
"updated_at": "2022-09-04T14:37:29.512680Z",
"structure_string": "Si3 Pt6\n1.0\n3.283566 -5.687304 -0.000000\n3.283566 5.687304 0.000000\n0.000000 0.000000 3.631705\nSi Pt\n3 6\ndirect\n0.333334 0.666668 0.000000 Si\n0.666668 0.333334 0.000000 Si\n0.000000 0.000000 0.500001 Si\n0.622973 0.000001 0.500001 Pt\n0.000001 0.622973 0.500001 Pt\n0.377027 0.377027 0.500001 Pt\n0.718223 0.718223 0.000000 Pt\n0.000000 0.281778 0.000000 Pt\n0.281778 0.000000 0.000000 Pt\n",
"nsites": 9,
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"elements": [
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"density": 15.360918446735218,
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"volume": 135.64155273016172,
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"formula_full": "Si3 Pt6",
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"formula_anonymous": "AB2",
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"spacegroup": 189
},
{
"id": "jvasp-58256",
"created_at": "2022-09-04T14:37:55.348236Z",
"updated_at": "2022-09-04T14:37:55.348252Z",
"structure_string": "Si6 Pt4\n1.0\n1.979914 -3.429312 0.000000\n1.979914 3.429312 -0.000000\n0.000000 0.000000 12.144553\nSi Pt\n6 4\ndirect\n0.333332 0.666666 0.433999 Si\n0.666666 0.333332 0.933998 Si\n0.666666 0.333332 0.566001 Si\n0.333332 0.666666 0.066001 Si\n0.000000 0.000000 0.750000 Si\n0.000000 0.000000 0.250000 Si\n0.333332 0.666666 0.636570 Pt\n0.666666 0.333332 0.136570 Pt\n0.666666 0.333332 0.363430 Pt\n0.333332 0.666666 0.863430 Pt\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Si",
"Pt"
],
"chemical_system": "Pt-Si",
"density": 9.553914398811141,
"density_atomic": 0.06063664222496345,
"volume": 164.9167835332925,
"volume_molar": 9.931520841239376,
"formula_full": "Si6 Pt4",
"formula_reduced": "Si3Pt2",
"formula_anonymous": "A2B3",
"energy_above_hull": 3.03290772,
"spacegroup": 194
},
{
"id": "jvasp-91690",
"created_at": "2022-09-04T14:36:15.123971Z",
"updated_at": "2022-09-04T14:36:15.123996Z",
"structure_string": "Si2 Pt6\n1.0\n0.000000 -0.000000 3.979129\n5.522226 -0.000000 0.000000\n0.000000 5.522226 0.000000\nSi Pt\n2 6\ndirect\n0.500000 0.500000 0.000000 Si\n0.500000 0.000000 0.500000 Si\n0.000000 0.318043 0.818043 Pt\n0.000000 0.681958 0.181957 Pt\n0.000000 0.181957 0.318043 Pt\n0.000000 0.818043 0.681958 Pt\n0.500000 0.500000 0.500000 Pt\n0.500000 0.000000 0.000000 Pt\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Si",
"Pt"
],
"chemical_system": "Pt-Si",
"density": 16.786580604047707,
"density_atomic": 0.06592856384068872,
"volume": 121.34345925282676,
"volume_molar": 9.134342399073091,
"formula_full": "Si2 Pt6",
"formula_reduced": "SiPt3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.6473357,
"spacegroup": 127
},
{
"id": "jvasp-88946",
"created_at": "2022-09-04T14:36:18.883428Z",
"updated_at": "2022-09-04T14:36:18.883453Z",
"structure_string": "Si2 Pt6\n1.0\n4.764655 0.048624 -2.628161\n-3.105519 4.595142 -0.079127\n0.044701 -0.028032 5.546445\nSi Pt\n2 6\ndirect\n0.078299 0.287203 0.287204 Si\n0.921700 0.712796 0.712797 Si\n0.500000 0.725624 0.274375 Pt\n0.500000 0.274375 0.725626 Pt\n-0.000000 0.815648 0.184351 Pt\n-0.000000 0.184352 0.815649 Pt\n0.639004 0.281403 0.281404 Pt\n0.360996 0.718596 0.718597 Pt\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Si",
"Pt"
],
"chemical_system": "Pt-Si",
"density": 16.618167950697384,
"density_atomic": 0.06526713048330152,
"volume": 122.57318409374206,
"volume_molar": 9.226912100173845,
"formula_full": "Si2 Pt6",
"formula_reduced": "SiPt3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.6315732,
"spacegroup": 12
},
{
"id": "jvasp-39090",
"created_at": "2022-09-04T14:37:49.950852Z",
"updated_at": "2022-09-04T14:37:49.950884Z",
"structure_string": "Si6 Pt2\n1.0\n3.752567 -6.499637 0.000000\n3.752567 6.499637 0.000000\n0.000000 0.000000 2.743738\nSi Pt\n6 2\ndirect\n0.169235 0.338469 0.250000 Si\n0.661532 0.830766 0.250000 Si\n0.169235 0.830766 0.250000 Si\n0.830766 0.661532 0.750000 Si\n0.338469 0.169235 0.750000 Si\n0.830766 0.169235 0.750000 Si\n0.333333 0.666667 0.750000 Pt\n0.666667 0.333333 0.250000 Pt\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Si",
"Pt"
],
"chemical_system": "Pt-Si",
"density": 6.9314294640816305,
"density_atomic": 0.0597722763654194,
"volume": 133.84131384074763,
"volume_molar": 10.075140393153982,
"formula_full": "Si6 Pt2",
"formula_reduced": "Si3Pt",
"formula_anonymous": "AB3",
"energy_above_hull": 3.0095043,
"spacegroup": 194
},
{
"id": "jvasp-91657",
"created_at": "2022-09-04T14:35:51.046152Z",
"updated_at": "2022-09-04T14:35:51.046175Z",
"structure_string": "Si4 Pd4\n1.0\n-0.000000 -0.000000 4.675555\n-4.142089 4.142089 2.337777\n-4.142089 -4.142089 2.337777\nSi Pd\n4 4\ndirect\n0.387460 0.500000 0.725082 Si\n0.612542 0.500000 0.274918 Si\n0.112542 0.274918 0.500000 Si\n0.887460 0.725082 0.500000 Si\n0.178020 0.500000 0.143961 Pd\n0.821982 0.500000 0.856039 Pd\n0.321981 0.856039 0.500000 Pd\n0.678021 0.143961 0.500000 Pd\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Si",
"Pd"
],
"chemical_system": "Pd-Si",
"density": 5.568613985635201,
"density_atomic": 0.04986409815388778,
"volume": 160.43607116508653,
"volume_molar": 12.077107544219103,
"formula_full": "Si4 Pd4",
"formula_reduced": "SiPd",
"formula_anonymous": "AB",
"energy_above_hull": 1.4649621499999996,
"spacegroup": 140
},
{
"id": "jvasp-14688",
"created_at": "2022-09-04T14:36:48.969045Z",
"updated_at": "2022-09-04T14:36:48.969077Z",
"structure_string": "Si4 Pd4\n1.0\n3.502011 -0.000000 0.000000\n0.000000 5.664107 0.000000\n0.000000 0.000000 6.165921\nSi Pd\n4 4\ndirect\n0.250000 0.679742 0.075027 Si\n0.750000 0.320259 0.924973 Si\n0.250000 0.179742 0.424973 Si\n0.750000 0.820259 0.575027 Si\n0.250000 0.502331 0.691953 Pd\n0.750000 0.497670 0.308047 Pd\n0.250000 0.002330 0.808047 Pd\n0.750000 0.997670 0.191953 Pd\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Si",
"Pd"
],
"chemical_system": "Pd-Si",
"density": 7.304697252896115,
"density_atomic": 0.06540983838033046,
"volume": 122.30576008280886,
"volume_molar": 9.206781287218304,
"formula_full": "Si4 Pd4",
"formula_reduced": "SiPd",
"formula_anonymous": "AB",
"energy_above_hull": 1.3702521499999996,
"spacegroup": 62
},
{
"id": "jvasp-86228",
"created_at": "2022-09-04T14:36:14.089417Z",
"updated_at": "2022-09-04T14:36:14.089428Z",
"structure_string": "Si3 Pd6\n1.0\n7.809887 0.000000 0.000000\n-3.904943 6.763561 0.000000\n-0.000000 0.000000 2.765675\nSi Pd\n3 6\ndirect\n0.000000 0.000000 0.500001 Si\n0.666667 0.333333 0.000000 Si\n0.333333 0.666667 0.000000 Si\n0.000000 0.253878 0.000000 Pd\n0.602124 -0.000000 0.000000 Pd\n0.746123 0.746122 0.000000 Pd\n0.000000 0.602124 0.000000 Pd\n0.397876 0.397876 0.000000 Pd\n0.253878 -0.000000 0.000000 Pd\n",
"nsites": 9,
"nelements": 2,
"elements": [
"Si",
"Pd"
],
"chemical_system": "Pd-Si",
"density": 8.21545868128865,
"density_atomic": 0.06160574360594658,
"volume": 146.09027459464448,
"volume_molar": 9.775291080844456,
"formula_full": "Si3 Pd6",
"formula_reduced": "SiPd2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.85507,
"spacegroup": 189
},
{
"id": "jvasp-86830",
"created_at": "2022-09-04T14:36:14.275014Z",
"updated_at": "2022-09-04T14:36:14.275039Z",
"structure_string": "Si3 Pd6\n1.0\n7.809656 0.000000 -0.000000\n-3.904828 6.763361 -0.000000\n-0.000000 -0.000000 2.765870\nSi Pd\n3 6\ndirect\n0.000000 0.000000 0.500000 Si\n0.666667 0.333333 0.000000 Si\n0.333333 0.666667 0.000000 Si\n-0.000000 0.253877 0.000000 Pd\n0.602113 -0.000000 0.000000 Pd\n0.746123 0.746122 0.000000 Pd\n-0.000000 0.602113 0.000000 Pd\n0.397887 0.397887 0.000000 Pd\n0.253878 -0.000000 0.000000 Pd\n",
"nsites": 9,
"nelements": 2,
"elements": [
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],
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"density": 8.215365389328708,
"density_atomic": 0.06160504403203506,
"volume": 146.09193356504926,
"volume_molar": 9.775402086992171,
"formula_full": "Si3 Pd6",
"formula_reduced": "SiPd2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.85507,
"spacegroup": 189
},
{
"id": "jvasp-52894",
"created_at": "2022-09-04T14:36:05.179152Z",
"updated_at": "2022-09-04T14:36:05.179178Z",
"structure_string": "Si3 Pd6\n1.0\n3.271013 -5.665561 -0.000000\n3.271013 5.665561 -0.000000\n0.000000 -0.000000 3.532934\nSi Pd\n3 6\ndirect\n0.666666 0.333333 0.000000 Si\n0.333333 0.666666 0.000000 Si\n0.000000 0.000000 0.499999 Si\n0.266003 0.266003 0.000000 Pd\n-0.000000 0.733996 0.000000 Pd\n0.733996 -0.000000 0.000000 Pd\n0.606894 0.606894 0.499999 Pd\n-0.000000 0.393106 0.499999 Pd\n0.393106 -0.000000 0.499999 Pd\n",
"nsites": 9,
"nelements": 2,
"elements": [
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],
"chemical_system": "Pd-Si",
"density": 9.165631890683262,
"density_atomic": 0.06873086338197619,
"volume": 130.94553970582214,
"volume_molar": 8.761916355584777,
"formula_full": "Si3 Pd6",
"formula_reduced": "SiPd2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.7091833333333335,
"spacegroup": 189
},
{
"id": "jvasp-16013",
"created_at": "2022-09-04T14:36:59.545849Z",
"updated_at": "2022-09-04T14:36:59.546029Z",
"structure_string": "Si1 P1\n1.0\n3.286543 -0.000000 1.897487\n1.095514 3.098582 1.897487\n0.000000 -0.000000 3.794973\nSi P\n1 1\ndirect\n0.000000 0.000000 0.000000 Si\n0.249999 0.250000 0.250001 P\n",
"nsites": 2,
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"elements": [
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"volume": 38.64657425896816,
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"formula_full": "Si1 P1",
"formula_reduced": "SiP",
"formula_anonymous": "AB",
"energy_above_hull": 2.15742205,
"spacegroup": 216
}
]
}