HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept
{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=677",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=675",
"results": [
{
"id": "jvasp-107410",
"created_at": "2022-09-04T14:36:55.226046Z",
"updated_at": "2022-09-04T14:36:55.226069Z",
"structure_string": "Rb2 Ga1 Hg1 Cl6\n1.0\n6.366792 -0.000000 3.675869\n2.122264 6.002669 3.675869\n-0.000000 -0.000000 7.351738\nRb Ga Hg Cl\n2 1 1 6\ndirect\n0.749999 0.750000 0.750001 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Ga\n0.500000 0.500000 0.500000 Hg\n0.767124 0.232876 0.232876 Cl\n0.232875 0.232876 0.767125 Cl\n0.232875 0.767124 0.767125 Cl\n0.232875 0.767124 0.232876 Cl\n0.767124 0.232876 0.767125 Cl\n0.767124 0.767124 0.232876 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Ga",
"Hg",
"Cl"
],
"chemical_system": "Cl-Ga-Hg-Rb",
"density": 3.8650007837496787,
"density_atomic": 0.03559138764165391,
"volume": 280.9668479544369,
"volume_molar": 16.920219072751372,
"formula_full": "Rb2 Ga1 Hg1 Cl6",
"formula_reduced": "Rb2GaHgCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-47882",
"created_at": "2022-09-04T14:36:46.569617Z",
"updated_at": "2022-09-04T14:36:46.569638Z",
"structure_string": "Li3 Co2 Si2 O8\n1.0\n4.977475 -0.013432 -0.015946\n0.042676 5.279867 0.011648\n0.028592 0.044279 6.350767\nLi Co Si O\n3 2 2 8\ndirect\n0.497515 0.174208 0.996133 Li\n0.996569 0.823863 0.499610 Li\n0.001835 0.340355 0.246060 Li\n0.990733 0.828436 0.982866 Co\n0.499762 0.167394 0.497545 Co\n0.991175 0.324590 0.747268 Si\n0.495367 0.678052 0.245695 Si\n0.104904 0.182515 0.965900 O\n0.664939 0.279295 0.744657 O\n0.067841 0.625570 0.748365 O\n0.111002 0.190122 0.529507 O\n0.605298 0.828244 0.454181 O\n0.598644 0.378152 0.254007 O\n0.161429 0.686662 0.237484 O\n0.614922 0.826442 0.037871 O\n",
"nsites": 15,
"nelements": 4,
"elements": [
"Li",
"Co",
"Si",
"O"
],
"chemical_system": "Co-Li-O-Si",
"density": 3.212108389707184,
"density_atomic": 0.08987192477855993,
"volume": 166.90418099934183,
"volume_molar": 6.700803142737026,
"formula_full": "Li3 Co2 Si2 O8",
"formula_reduced": "Li3Co2(SiO4)2",
"formula_anonymous": "A2B2C3D8",
"energy_above_hull": 2.690202466666667,
"spacegroup": 1
},
{
"id": "jvasp-58153",
"created_at": "2022-09-04T14:36:54.663058Z",
"updated_at": "2022-09-04T14:36:54.663090Z",
"structure_string": "Ba1 Ca1 Ti4 O8\n1.0\n2.783752 -4.821600 -0.000000\n2.783752 4.821600 -0.000000\n-0.000000 -0.000000 7.696400\nBa Ca Ti O\n1 1 4 8\ndirect\n0.000000 0.000000 0.000000 Ba\n0.000000 0.000000 0.500000 Ca\n0.333333 0.666667 0.755402 Ti\n0.666667 0.333333 0.755402 Ti\n0.333333 0.666667 0.244598 Ti\n0.666667 0.333333 0.244598 Ti\n0.328425 0.328425 0.693274 O\n0.671575 -0.000000 0.693274 O\n-0.000000 0.671575 0.693274 O\n0.671574 0.671574 0.306726 O\n-0.000000 0.328425 0.306726 O\n0.328425 -0.000000 0.306726 O\n0.333333 0.666667 0.000000 O\n0.666667 0.333333 0.000000 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Ba",
"Ca",
"Ti",
"O"
],
"chemical_system": "Ba-Ca-O-Ti",
"density": 3.9934748414965915,
"density_atomic": 0.06776238583079155,
"volume": 206.60429570704892,
"volume_molar": 8.88714393120366,
"formula_full": "Ba1 Ca1 Ti4 O8",
"formula_reduced": "BaCaTi4O8",
"formula_anonymous": "ABC4D8",
"energy_above_hull": 2.781153408809524,
"spacegroup": 162
},
{
"id": "jvasp-102686",
"created_at": "2022-09-04T14:36:54.444822Z",
"updated_at": "2022-09-04T14:36:54.444842Z",
"structure_string": "Sb1 Pb1 I1 O2\n1.0\n3.836883 0.008946 -6.382962\n-0.287660 3.826095 -6.382962\n-0.008280 -0.008946 7.447403\nSb Pb I O\n1 1 1 2\ndirect\n0.323081 0.323082 0.000001 Sb\n0.648086 0.648088 0.000001 Pb\n0.993841 0.993844 0.000002 I\n0.753895 0.253896 0.500000 O\n0.253895 0.753896 0.500000 O\n",
"nsites": 5,
"nelements": 4,
"elements": [
"Sb",
"Pb",
"I",
"O"
],
"chemical_system": "I-O-Pb-Sb",
"density": 7.438271913921167,
"density_atomic": 0.04590868307453012,
"volume": 108.9118586103371,
"volume_molar": 13.117650859693361,
"formula_full": "Sb1 Pb1 I1 O2",
"formula_reduced": "SbPbIO2",
"formula_anonymous": "ABCD2",
"energy_above_hull": 1.114536039,
"spacegroup": 107
},
{
"id": "jvasp-101877",
"created_at": "2022-09-04T14:36:46.717235Z",
"updated_at": "2022-09-04T14:36:46.717243Z",
"structure_string": "Sn1 H12 C7 O4\n1.0\n5.157872 0.017882 0.081255\n-0.744614 6.207067 -0.378830\n0.106525 0.295824 7.022876\nSn H C O\n1 12 7 4\ndirect\n-0.002488 0.667457 0.638762 Sn\n0.996057 0.273634 0.483713 H\n0.143884 0.469705 0.318458 H\n0.080028 0.892031 0.963178 H\n0.767248 0.920780 0.868400 H\n0.055710 0.076451 0.772165 H\n0.327234 0.390856 0.517517 H\n0.347555 0.327153 0.029327 H\n0.623238 0.280836 0.297879 H\n0.835498 0.136507 0.157981 H\n0.488653 0.827522 0.124128 H\n0.263887 0.968309 0.261930 H\n0.465291 0.117066 0.899688 H\n0.471326 0.948216 0.238995 C\n0.630104 0.161887 0.181141 C\n0.525339 0.248838 0.000888 C\n0.717193 0.400653 0.888611 C\n0.136046 0.417814 0.466784 C\n0.975962 0.924537 0.835985 C\n0.571434 0.863438 0.419735 C\n0.435629 0.859684 0.571928 O\n0.629928 0.480670 0.737268 O\n0.954292 0.445538 0.930743 O\n0.803346 0.801312 0.405653 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Sn",
"H",
"C",
"O"
],
"chemical_system": "C-H-O-Sn",
"density": 2.054164265816732,
"density_atomic": 0.10645924984502145,
"volume": 225.4383722874068,
"volume_molar": 5.656756710916863,
"formula_full": "Sn1 H12 C7 O4",
"formula_reduced": "SnH12C7O4",
"formula_anonymous": "AB4C7D12",
"energy_above_hull": 4.401464404166667,
"spacegroup": 1
},
{
"id": "jvasp-104690",
"created_at": "2022-09-04T14:36:46.837992Z",
"updated_at": "2022-09-04T14:36:46.838010Z",
"structure_string": "Ta1 Fe1 Pb2 O6\n1.0\n4.827707 -0.000000 2.787278\n1.609236 4.551606 2.787278\n-0.000000 -0.000000 5.574556\nTa Fe Pb O\n1 1 2 6\ndirect\n0.000000 0.000000 0.000000 Ta\n0.500001 0.500000 0.500000 Fe\n0.750001 0.750001 0.750000 Pb\n0.250000 0.250000 0.250000 Pb\n0.254173 0.745828 0.745827 O\n0.745828 0.254173 0.254173 O\n0.745828 0.254173 0.745828 O\n0.254173 0.745828 0.254173 O\n0.745828 0.745828 0.254173 O\n0.254173 0.254173 0.745828 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ta",
"Fe",
"Pb",
"O"
],
"chemical_system": "Fe-O-Pb-Ta",
"density": 10.128937275397362,
"density_atomic": 0.0816364576894537,
"volume": 122.49429094584369,
"volume_molar": 7.376778623722641,
"formula_full": "Ta1 Fe1 Pb2 O6",
"formula_reduced": "TaFe(PbO3)2",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.815999734,
"spacegroup": 225
},
{
"id": "jvasp-102660",
"created_at": "2022-09-04T14:36:46.838473Z",
"updated_at": "2022-09-04T14:36:46.838494Z",
"structure_string": "U1 Cu1 Ni1 Ge2\n1.0\n3.793877 0.009346 -4.369825\n-0.522358 3.757757 -4.369825\n-0.008116 -0.009346 5.786952\nU Cu Ni Ge\n1 1 1 2\ndirect\n0.000000 0.000000 0.000000 U\n0.249999 0.750000 0.499999 Cu\n0.750000 0.250001 0.499999 Ni\n0.622736 0.622737 0.000000 Ge\n0.377265 0.377265 0.000000 Ge\n",
"nsites": 5,
"nelements": 4,
"elements": [
"U",
"Cu",
"Ni",
"Ge"
],
"chemical_system": "Cu-Ge-Ni-U",
"density": 10.210134988564004,
"density_atomic": 0.060812061760212366,
"volume": 82.22053084987427,
"volume_molar": 9.902872202797303,
"formula_full": "U1 Cu1 Ni1 Ge2",
"formula_reduced": "UCuNiGe2",
"formula_anonymous": "ABCD2",
"energy_above_hull": 1.6830141499999998,
"spacegroup": 119
},
{
"id": "jvasp-48612",
"created_at": "2022-09-04T14:36:46.829259Z",
"updated_at": "2022-09-04T14:36:46.829281Z",
"structure_string": "Li4 Fe2 Si2 O8\n1.0\n4.919683 0.151595 -0.053115\n0.220000 5.377016 -0.097415\n-0.052179 0.053405 6.278204\nLi Fe Si O\n4 2 2 8\ndirect\n0.493332 0.838147 0.501553 Li\n0.983224 0.654285 0.736491 Li\n0.509797 0.339950 0.267589 Li\n0.007910 0.155960 0.500386 Li\n0.012930 0.144923 0.004069 Fe\n0.434146 0.844848 -0.003259 Fe\n-0.005721 0.663969 0.261223 Si\n0.512364 0.336217 0.741249 Si\n0.871668 0.810619 0.036940 O\n0.883199 0.812577 0.471487 O\n0.331181 0.673208 0.251246 O\n0.390879 0.631211 0.746177 O\n0.912346 0.370992 0.249572 O\n0.850646 0.318574 0.750564 O\n0.399872 0.188791 0.534983 O\n0.419505 0.213133 0.972467 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Li",
"Fe",
"Si",
"O"
],
"chemical_system": "Fe-Li-O-Si",
"density": 3.2395922565344835,
"density_atomic": 0.09645519324491453,
"volume": 165.88013005555385,
"volume_molar": 6.243459328010325,
"formula_full": "Li4 Fe2 Si2 O8",
"formula_reduced": "Li2FeSiO4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 2.2770322625,
"spacegroup": 1
},
{
"id": "jvasp-102159",
"created_at": "2022-09-04T14:36:46.788936Z",
"updated_at": "2022-09-04T14:36:46.788954Z",
"structure_string": "Ba2 Sm1 Ta1 O6\n1.0\n5.273525 -0.000000 3.044672\n1.757842 4.971928 3.044672\n0.000000 -0.000000 6.089343\nBa Sm Ta O\n2 1 1 6\ndirect\n0.750000 0.750000 0.749999 Ba\n0.250000 0.250000 0.250000 Ba\n0.500000 0.500000 0.499999 Sm\n0.000000 0.000000 0.000000 Ta\n0.233128 0.766872 0.233128 O\n0.766872 0.233128 0.766871 O\n0.233128 0.233128 0.766871 O\n0.233128 0.766872 0.766871 O\n0.766872 0.766872 0.233127 O\n0.766872 0.233128 0.233128 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ba",
"Sm",
"Ta",
"O"
],
"chemical_system": "Ba-O-Sm-Ta",
"density": 7.300693580307379,
"density_atomic": 0.06263307329522923,
"volume": 159.66005616335775,
"volume_molar": 9.614953319652459,
"formula_full": "Ba2 Sm1 Ta1 O6",
"formula_reduced": "Ba2SmTaO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.3247621014999997,
"spacegroup": 225
},
{
"id": "jvasp-102351",
"created_at": "2022-09-04T14:36:41.196688Z",
"updated_at": "2022-09-04T14:36:41.196718Z",
"structure_string": "Ba2 U1 Co1 O6\n1.0\n5.135865 -0.000000 2.965193\n1.711955 4.842140 2.965193\n-0.000000 -0.000000 5.930386\nBa U Co O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Ba\n0.749999 0.750000 0.750001 Ba\n0.000000 0.000000 0.000000 U\n0.499999 0.500000 0.500000 Co\n0.749107 0.250892 0.749109 O\n0.250891 0.250892 0.749109 O\n0.749107 0.749108 0.250892 O\n0.749107 0.250892 0.250892 O\n0.250891 0.749108 0.250892 O\n0.250891 0.749108 0.749109 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ba",
"U",
"Co",
"O"
],
"chemical_system": "Ba-Co-O-U",
"density": 7.516915305353175,
"density_atomic": 0.06780568327652706,
"volume": 147.48026296288052,
"volume_molar": 8.881469028842812,
"formula_full": "Ba2 U1 Co1 O6",
"formula_reduced": "Ba2UCoO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.494835984,
"spacegroup": 225
},
{
"id": "jvasp-27712",
"created_at": "2022-09-04T14:37:03.026006Z",
"updated_at": "2022-09-04T14:37:03.026039Z",
"structure_string": "Ca2 Cr2 Ge4 O12\n1.0\n5.381517 -0.120749 1.074612\n1.214935 6.667994 0.837243\n-0.127878 0.127123 6.826908\nCa Cr Ge O\n2 2 4 12\ndirect\n0.750001 0.308843 0.691156 Ca\n0.250001 0.691155 0.308844 Ca\n0.750001 0.911838 0.088160 Cr\n0.250000 0.088161 0.911839 Cr\n0.776511 0.387321 0.183639 Ge\n0.723491 0.816360 0.612678 Ge\n0.223490 0.612678 0.816361 Ge\n0.276511 0.183639 0.387322 Ge\n0.625434 0.982934 0.804956 O\n0.874568 0.195043 0.017064 O\n0.649068 0.637093 0.103850 O\n0.850934 0.896149 0.362906 O\n0.350933 0.362906 0.896150 O\n0.969137 0.603290 0.676778 O\n0.030864 0.396709 0.323222 O\n0.469137 0.676778 0.603290 O\n0.125434 0.804956 0.982935 O\n0.530865 0.323221 0.396709 O\n0.149067 0.103850 0.637094 O\n0.374567 0.017065 0.195043 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Ca",
"Cr",
"Ge",
"O"
],
"chemical_system": "Ca-Cr-Ge-O",
"density": 4.491205473253921,
"density_atomic": 0.08113583615853068,
"volume": 246.50020196898146,
"volume_molar": 7.422294568128178,
"formula_full": "Ca2 Cr2 Ge4 O12",
"formula_reduced": "CaCr(GeO3)2",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.2383100720000004,
"spacegroup": 15
},
{
"id": "jvasp-104161",
"created_at": "2022-09-04T14:36:55.181669Z",
"updated_at": "2022-09-04T14:36:55.181688Z",
"structure_string": "H3 C3 S2 N1\n1.0\n4.814992 0.006752 0.590020\n0.298962 4.490295 2.479586\n-0.017988 0.010648 5.138572\nH C S N\n3 3 2 1\ndirect\n0.877742 0.600828 0.697556 H\n0.401816 0.731598 0.763585 H\n0.926063 0.797373 0.891467 H\n0.901953 0.573139 0.921012 C\n0.638694 0.457023 0.118089 C\n0.165145 0.376593 0.037738 C\n0.624549 0.284095 0.483426 S\n0.179209 0.011208 0.210787 S\n0.401817 0.534009 0.961027 N\n",
"nsites": 9,
"nelements": 4,
"elements": [
"H",
"C",
"S",
"N"
],
"chemical_system": "C-H-N-S",
"density": 1.752998925030906,
"density_atomic": 0.08107273012653621,
"volume": 111.01143363438032,
"volume_molar": 7.428071992395963,
"formula_full": "H3 C3 S2 N1",
"formula_reduced": "H3C3S2N",
"formula_anonymous": "AB2C3D3",
"energy_above_hull": 4.584220361111111,
"spacegroup": 5
}
]
}