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{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-elements&page=4547",
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"results": [
{
"id": "jvasp-90852",
"created_at": "2022-09-04T14:36:13.994568Z",
"updated_at": "2022-09-04T14:36:13.994583Z",
"structure_string": "Al2 Pt6\n1.0\n-5.520064 0.000000 -0.000000\n0.000000 5.520064 0.000000\n2.760032 -2.760032 -3.984933\nAl Pt\n2 6\ndirect\n0.250000 0.749999 0.500000 Al\n0.749999 0.250000 0.500000 Al\n0.749999 0.749999 0.500000 Pt\n0.250000 0.250000 0.500000 Pt\n0.794071 0.705928 0.000000 Pt\n0.205928 0.294071 0.000000 Pt\n0.705928 0.205928 0.000000 Pt\n0.294071 0.794071 0.000000 Pt\n",
"nsites": 8,
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"elements": [
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"density": 16.745069721668088,
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"volume": 121.42531809378275,
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"formula_full": "Al2 Pt6",
"formula_reduced": "AlPt3",
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"spacegroup": 140
},
{
"id": "jvasp-20161",
"created_at": "2022-09-04T14:38:13.634678Z",
"updated_at": "2022-09-04T14:38:13.634694Z",
"structure_string": "Al6 Pt10\n1.0\n4.003127 0.000000 0.000000\n0.000000 5.473913 0.000000\n0.000000 0.000000 10.917031\nAl Pt\n6 10\ndirect\n0.500000 0.179137 0.640136 Al\n0.500000 0.820862 0.359863 Al\n0.500000 0.679137 0.859863 Al\n0.500000 0.320863 0.140136 Al\n0.000000 0.500000 0.500000 Al\n0.000000 0.000000 0.000000 Al\n0.500000 0.292428 0.393099 Pt\n0.500000 0.707572 0.606901 Pt\n0.500000 0.792427 0.106901 Pt\n0.500000 0.207572 0.893099 Pt\n0.000000 0.426010 0.729348 Pt\n0.000000 0.573989 0.270651 Pt\n0.000000 0.926010 0.770651 Pt\n0.000000 0.073990 0.229348 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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"density": 14.665306233178969,
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"volume": 239.22237766044375,
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"formula_full": "Al6 Pt10",
"formula_reduced": "Al3Pt5",
"formula_anonymous": "A3B5",
"energy_above_hull": 2.534150675,
"spacegroup": 55
},
{
"id": "jvasp-98460",
"created_at": "2022-09-04T14:36:11.917019Z",
"updated_at": "2022-09-04T14:36:11.917048Z",
"structure_string": "Al4 Pt8\n1.0\n4.113315 0.000000 0.000000\n0.000000 5.480551 0.000000\n0.000000 0.000000 7.990255\nAl Pt\n4 8\ndirect\n0.749999 0.307171 0.396387 Al\n0.250000 0.692828 0.603612 Al\n0.749999 0.807171 0.103613 Al\n0.250000 0.192828 0.896387 Al\n0.749999 0.957992 0.792856 Pt\n0.250000 0.042008 0.207143 Pt\n0.749999 0.457992 0.707143 Pt\n0.250000 0.542008 0.292856 Pt\n0.749999 0.840484 0.430724 Pt\n0.250000 0.159516 0.569275 Pt\n0.749999 0.340484 0.069275 Pt\n0.250000 0.659516 0.930724 Pt\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Al",
"Pt"
],
"chemical_system": "Al-Pt",
"density": 15.382397292369284,
"density_atomic": 0.06661996707257298,
"volume": 180.1261772904767,
"volume_molar": 9.039543285033051,
"formula_full": "Al4 Pt8",
"formula_reduced": "AlPt2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.7590518666666668,
"spacegroup": 62
},
{
"id": "jvasp-17427",
"created_at": "2022-09-04T14:38:32.879540Z",
"updated_at": "2022-09-04T14:38:32.879579Z",
"structure_string": "Al2 Pd1\n1.0\n3.643069 0.000000 2.103326\n1.214357 3.434718 2.103326\n-0.000000 -0.000000 4.206654\nAl Pd\n2 1\ndirect\n0.250000 0.250000 0.250000 Al\n0.750001 0.750000 0.750000 Al\n0.000000 0.000000 0.000000 Pd\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Al",
"Pd"
],
"chemical_system": "Al-Pd",
"density": 5.0595554961584535,
"density_atomic": 0.05699358546431619,
"volume": 52.63750254628754,
"volume_molar": 10.566348319620069,
"formula_full": "Al2 Pd1",
"formula_reduced": "Al2Pd",
"formula_anonymous": "AB2",
"energy_above_hull": 1.271413766666667,
"spacegroup": 225
},
{
"id": "jvasp-20808",
"created_at": "2022-09-04T14:38:34.626229Z",
"updated_at": "2022-09-04T14:38:34.626247Z",
"structure_string": "Al4 Pd8\n1.0\n4.100289 0.000000 0.000000\n0.000000 5.489718 0.000000\n0.000000 0.000000 7.856624\nAl Pd\n4 8\ndirect\n0.750000 0.301414 0.605499 Al\n0.250000 0.698587 0.394501 Al\n0.750000 0.801414 0.894500 Al\n0.250000 0.198587 0.105499 Al\n0.750000 0.959124 0.210020 Pd\n0.250000 0.040877 0.789980 Pd\n0.750000 0.459124 0.289980 Pd\n0.250000 0.540877 0.710019 Pd\n0.750000 0.835061 0.566770 Pd\n0.250000 0.164939 0.433230 Pd\n0.750000 0.335061 0.933229 Pd\n0.250000 0.664939 0.066770 Pd\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Al",
"Pd"
],
"chemical_system": "Al-Pd",
"density": 9.007345062221152,
"density_atomic": 0.06785483093885729,
"volume": 176.8481305452367,
"volume_molar": 8.875036127385592,
"formula_full": "Al4 Pd8",
"formula_reduced": "AlPd2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.211178066666667,
"spacegroup": 62
},
{
"id": "jvasp-16374",
"created_at": "2022-09-04T14:37:55.807801Z",
"updated_at": "2022-09-04T14:37:55.807815Z",
"structure_string": "Al3 Pd2\n1.0\n2.123885 -3.678677 0.000000\n2.123885 3.678677 -0.000000\n0.000000 -0.000000 5.215198\nAl Pd\n3 2\ndirect\n0.000000 0.000000 0.000000 Al\n0.666668 0.333334 0.354235 Al\n0.333334 0.666668 0.645765 Al\n0.666668 0.333334 0.840111 Pd\n0.333334 0.666668 0.159890 Pd\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Al",
"Pd"
],
"chemical_system": "Al-Pd",
"density": 5.986247870553361,
"density_atomic": 0.061354518539055374,
"volume": 81.4935903509248,
"volume_molar": 9.815317442620941,
"formula_full": "Al3 Pd2",
"formula_reduced": "Al3Pd2",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.63147996,
"spacegroup": 164
},
{
"id": "jvasp-19854",
"created_at": "2022-09-04T14:37:00.273278Z",
"updated_at": "2022-09-04T14:37:00.273292Z",
"structure_string": "Al1 Pd1\n1.0\n3.078511 0.000000 0.000000\n0.000000 3.078511 -0.000000\n0.000000 0.000000 3.078511\nAl Pd\n1 1\ndirect\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.500000 Pd\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Al",
"Pd"
],
"chemical_system": "Al-Pd",
"density": 7.592552556861926,
"density_atomic": 0.06855006429576736,
"volume": 29.175756734096755,
"volume_molar": 8.785025691612429,
"formula_full": "Al1 Pd1",
"formula_reduced": "AlPd",
"formula_anonymous": "AB",
"energy_above_hull": 0.6908192500000001,
"spacegroup": 221
},
{
"id": "jvasp-105113",
"created_at": "2022-09-04T14:36:41.115052Z",
"updated_at": "2022-09-04T14:36:41.115073Z",
"structure_string": "Al3 Pd1\n1.0\n3.963060 -0.000000 0.000000\n0.000000 3.963060 0.000000\n-0.000000 -0.000000 3.963060\nAl Pd\n3 1\ndirect\n-0.000000 0.500000 0.500000 Al\n0.500000 0.000000 0.500000 Al\n0.500000 0.500000 -0.000000 Al\n0.000000 0.000000 0.000000 Pd\n",
"nsites": 4,
"nelements": 2,
"elements": [
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],
"chemical_system": "Al-Pd",
"density": 4.998557954275783,
"density_atomic": 0.06426404362326564,
"volume": 62.243204356220616,
"volume_molar": 9.370933449665143,
"formula_full": "Al3 Pd1",
"formula_reduced": "Al3Pd",
"formula_anonymous": "AB3",
"energy_above_hull": 1.594616025,
"spacegroup": 221
},
{
"id": "jvasp-15772",
"created_at": "2022-09-04T14:36:55.236778Z",
"updated_at": "2022-09-04T14:36:55.236790Z",
"structure_string": "Al4 Pd4\n1.0\n4.908900 0.000000 -0.000000\n-0.000000 4.908900 0.000000\n0.000000 -0.000000 4.908900\nAl Pd\n4 4\ndirect\n0.844019 0.844019 0.844019 Al\n0.655981 0.155981 0.344019 Al\n0.344019 0.655981 0.155981 Al\n0.155981 0.344019 0.655981 Al\n0.148297 0.148297 0.148297 Pd\n0.351703 0.851703 0.648297 Pd\n0.648297 0.351703 0.851703 Pd\n0.851703 0.648297 0.351703 Pd\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Al",
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],
"chemical_system": "Al-Pd",
"density": 7.490613208513098,
"density_atomic": 0.06762969544336274,
"volume": 118.291232091969,
"volume_molar": 8.904580629145832,
"formula_full": "Al4 Pd4",
"formula_reduced": "AlPd",
"formula_anonymous": "AB",
"energy_above_hull": 0.6670992500000001,
"spacegroup": 198
},
{
"id": "jvasp-106489",
"created_at": "2022-09-04T14:36:56.101486Z",
"updated_at": "2022-09-04T14:36:56.101502Z",
"structure_string": "Al2 Pb6\n1.0\n6.870603 0.000000 0.000000\n-3.435302 5.950117 0.000000\n0.000000 0.000000 5.681605\nAl Pb\n2 6\ndirect\n0.666667 0.333334 0.250000 Al\n0.333334 0.666667 0.750001 Al\n0.830536 0.169464 0.750001 Pb\n0.338928 0.169464 0.750001 Pb\n0.830536 0.661072 0.750001 Pb\n0.169465 0.830536 0.250000 Pb\n0.661072 0.830536 0.250000 Pb\n0.169464 0.338928 0.250000 Pb\n",
"nsites": 8,
"nelements": 2,
"elements": [
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],
"chemical_system": "Al-Pb",
"density": 9.273683682134688,
"density_atomic": 0.03444281108424992,
"volume": 232.26907874712512,
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"formula_full": "Al2 Pb6",
"formula_reduced": "AlPb3",
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"spacegroup": 194
},
{
"id": "jvasp-105717",
"created_at": "2022-09-04T14:35:58.857029Z",
"updated_at": "2022-09-04T14:35:58.857054Z",
"structure_string": "Al1 Pb3\n1.0\n4.396755 -0.186790 -3.914085\n-1.007606 4.283815 -3.914085\n0.154517 0.186790 5.884525\nAl Pb\n1 3\ndirect\n0.000000 0.000000 0.000000 Al\n0.749999 0.250000 0.500000 Pb\n0.249999 0.750001 0.500001 Pb\n0.499999 0.500001 0.000001 Pb\n",
"nsites": 4,
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"density": 9.25398090224402,
"density_atomic": 0.034369634216365574,
"volume": 116.3818030421559,
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"formula_full": "Al1 Pb3",
"formula_reduced": "AlPb3",
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"spacegroup": 139
},
{
"id": "jvasp-1327",
"created_at": "2022-09-04T14:35:48.899531Z",
"updated_at": "2022-09-04T14:35:48.899551Z",
"structure_string": "Al1 P1\n1.0\n3.376807 0.000000 1.949600\n1.125603 3.183684 1.949600\n-0.000000 -0.000000 3.899201\nAl P\n1 1\ndirect\n0.000000 0.000000 0.000000 Al\n0.250000 0.250000 0.250000 P\n",
"nsites": 2,
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"elements": [
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"chemical_system": "Al-P",
"density": 2.295780922896858,
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"volume": 41.919087227806024,
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"formula_full": "Al1 P1",
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]
}