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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-56361",
"created_at": "2022-09-04T14:38:36.282524Z",
"updated_at": "2022-09-04T14:38:36.282552Z",
"structure_string": "Al6 Pt4\n1.0\n2.054021 -3.557669 0.000000\n2.054021 3.557669 -0.000000\n0.000000 0.000000 11.345275\nAl Pt\n6 4\ndirect\n0.333333 0.666667 0.333587 Al\n0.666667 0.333333 0.666413 Al\n0.000000 0.000000 0.500000 Al\n0.000000 0.000000 0.000000 Al\n0.000000 0.000000 0.776872 Al\n0.000000 0.000000 0.223128 Al\n0.333333 0.666667 0.589490 Pt\n0.333333 0.666667 0.106830 Pt\n0.666667 0.333333 0.410510 Pt\n0.666667 0.333333 0.893170 Pt\n",
"nsites": 10,
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"elements": [
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"formula_full": "Al6 Pt4",
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{
"id": "jvasp-98682",
"created_at": "2022-09-04T14:35:52.711175Z",
"updated_at": "2022-09-04T14:35:52.711206Z",
"structure_string": "Al8 Pt16\n1.0\n3.957397 0.000000 0.000000\n0.000000 5.514333 -0.000000\n0.000000 0.000000 16.544940\nAl Pt\n8 16\ndirect\n0.000000 0.202707 0.750000 Al\n0.000000 0.797293 0.250000 Al\n0.000000 0.683811 0.591997 Al\n0.000000 0.316188 0.408003 Al\n0.000000 0.683811 0.908003 Al\n0.000000 0.316188 0.091997 Al\n0.500000 0.000000 0.500000 Al\n0.500000 0.000000 0.000000 Al\n0.000000 0.799709 0.431937 Pt\n0.000000 0.200290 0.568063 Pt\n0.500000 0.500000 0.000000 Pt\n0.500000 0.500000 0.500000 Pt\n0.500000 0.058298 0.154592 Pt\n0.500000 0.941702 0.845408 Pt\n0.000000 0.729063 0.750000 Pt\n0.500000 0.437064 0.831920 Pt\n0.500000 0.437064 0.668080 Pt\n0.500000 0.562936 0.331920 Pt\n0.000000 0.200290 0.931937 Pt\n0.500000 0.562936 0.168080 Pt\n0.500000 0.941702 0.654592 Pt\n0.500000 0.058298 0.345408 Pt\n0.000000 0.270937 0.250000 Pt\n0.000000 0.799709 0.068063 Pt\n",
"nsites": 24,
"nelements": 2,
"elements": [
"Al",
"Pt"
],
"chemical_system": "Al-Pt",
"density": 15.348397791995641,
"density_atomic": 0.0664727178790744,
"volume": 361.0503792497282,
"volume_molar": 9.059567522055193,
"formula_full": "Al8 Pt16",
"formula_reduced": "AlPt2",
"formula_anonymous": "AB2",
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"spacegroup": 51
},
{
"id": "jvasp-7864",
"created_at": "2022-09-04T14:36:41.787258Z",
"updated_at": "2022-09-04T14:36:41.787274Z",
"structure_string": "Al1 Pt3\n1.0\n3.925145 -0.000000 0.000000\n0.000000 3.925145 0.000000\n0.000000 0.000000 3.925145\nAl Pt\n1 3\ndirect\n0.000000 0.000000 0.000000 Al\n0.000000 0.499999 0.499999 Pt\n0.499999 0.499999 0.000000 Pt\n0.499999 0.000000 0.499999 Pt\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Al",
"Pt"
],
"chemical_system": "Al-Pt",
"density": 16.811214906086025,
"density_atomic": 0.06614436888090236,
"volume": 60.47377981944743,
"volume_molar": 9.104540359048995,
"formula_full": "Al1 Pt3",
"formula_reduced": "AlPt3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.21781425,
"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": [
"Al",
"Pd"
],
"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-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",
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],
"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-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",
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],
"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-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": [
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],
"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-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": [
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],
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"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,
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"elements": [
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],
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"density": 9.273683682134688,
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"volume": 232.26907874712512,
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"formula_full": "Al2 Pb6",
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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,
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"formula_full": "Al1 Pb3",
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},
{
"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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"density": 2.295780922896858,
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"volume": 41.919087227806024,
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"formula_full": "Al1 P1",
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}