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=density_atomic&page=1107",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density_atomic&page=1105",
"results": [
{
"id": "jvasp-114396",
"created_at": "2022-09-04T14:38:40.601924Z",
"updated_at": "2022-09-04T14:38:40.601958Z",
"structure_string": "Sr1 Ta1 O1\n1.0\n3.116235 0.000000 0.000000\n0.000000 3.116235 0.000000\n-0.000000 0.000000 7.526931\nSr Ta O\n1 1 1\ndirect\n0.000000 0.000000 0.540744 Sr\n0.000000 0.000000 -0.000259 Ta\n0.000000 0.000000 0.237206 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Sr",
"Ta",
"O"
],
"chemical_system": "O-Sr-Ta",
"density": 6.464809371098148,
"density_atomic": 0.041043361028127535,
"volume": 73.09342911619889,
"volume_molar": 14.672630625627736,
"formula_full": "Sr1 Ta1 O1",
"formula_reduced": "SrTaO",
"formula_anonymous": "ABC",
"energy_above_hull": 2.36380967,
"spacegroup": 99
},
{
"id": "jvasp-37752",
"created_at": "2022-09-04T14:38:04.256015Z",
"updated_at": "2022-09-04T14:38:04.256034Z",
"structure_string": "Pm1 Y1 Al2\n1.0\n0.000000 3.652544 3.652544\n3.652544 0.000000 3.652544\n3.652544 3.652544 0.000000\nPm Y Al\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Pm\n0.750000 0.750000 0.750000 Y\n0.499998 0.499998 0.499998 Al\n0.000000 0.000000 0.000000 Al\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pm",
"Y",
"Al"
],
"chemical_system": "Al-Pm-Y",
"density": 4.9048702365129335,
"density_atomic": 0.04104342802306177,
"volume": 97.4577464083276,
"volume_molar": 14.67260667558333,
"formula_full": "Pm1 Y1 Al2",
"formula_reduced": "PmYAl2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.85740805625,
"spacegroup": 225
},
{
"id": "jvasp-37856",
"created_at": "2022-09-04T14:37:57.498368Z",
"updated_at": "2022-09-04T14:37:57.498381Z",
"structure_string": "Dy6 Sb8 Au6\n1.0\n-4.957073 4.957216 4.957216\n4.957216 -4.957073 4.957216\n4.957216 4.957216 -4.957073\nDy Sb Au\n6 8 6\ndirect\n0.250002 0.625003 0.375002 Dy\n0.750001 0.875002 0.125001 Dy\n0.375002 0.250002 0.625003 Dy\n0.625003 0.375002 0.250002 Dy\n0.125001 0.750001 0.875002 Dy\n0.875002 0.125001 0.750001 Dy\n0.819070 0.499999 -0.000000 Sb\n-0.000000 0.819070 0.499999 Sb\n0.499999 -0.000000 0.819070 Sb\n0.680929 0.680929 0.680929 Sb\n-0.000003 0.319071 0.499997 Sb\n0.319071 0.499997 -0.000003 Sb\n0.499997 -0.000003 0.319071 Sb\n0.180930 0.180930 0.180930 Sb\n0.250002 0.125002 0.875002 Au\n0.750002 0.375003 0.625004 Au\n0.875002 0.250002 0.125002 Au\n0.125002 0.875002 0.250002 Au\n0.625004 0.750002 0.375003 Au\n0.375003 0.625004 0.750002 Au\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Dy",
"Sb",
"Au"
],
"chemical_system": "Au-Dy-Sb",
"density": 10.669447215208683,
"density_atomic": 0.0410446424070302,
"volume": 487.27431467582636,
"volume_molar": 14.6721725585518,
"formula_full": "Dy6 Sb8 Au6",
"formula_reduced": "Dy3Sb4Au3",
"formula_anonymous": "A3B3C4",
"energy_above_hull": 1.3498326610000002,
"spacegroup": 220
},
{
"id": "jvasp-36933",
"created_at": "2022-09-04T14:38:35.183031Z",
"updated_at": "2022-09-04T14:38:35.183057Z",
"structure_string": "Ba4 Hf4 S12\n1.0\n3.869058 0.000000 0.000000\n-0.000000 8.718955 0.000000\n0.000000 0.000000 14.444372\nBa Hf S\n4 4 12\ndirect\n0.750000 0.068077 0.325961 Ba\n0.250000 0.931923 0.674039 Ba\n0.750000 0.568077 0.174039 Ba\n0.250000 0.431923 0.825961 Ba\n0.250000 0.163174 0.059381 Hf\n0.750000 0.836827 0.940619 Hf\n0.250000 0.663174 0.440619 Hf\n0.750000 0.336826 0.559381 Hf\n0.750000 0.715550 0.789304 S\n0.250000 0.284450 0.210696 S\n0.750000 0.476696 0.396903 S\n0.250000 0.523305 0.603097 S\n0.750000 0.976696 0.103097 S\n0.250000 0.672555 0.003816 S\n0.250000 0.172555 0.496184 S\n0.750000 0.827445 0.503816 S\n0.250000 0.784450 0.289304 S\n0.750000 0.327445 0.996183 S\n0.250000 0.023305 0.896903 S\n0.750000 0.215550 0.710696 S\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Ba",
"Hf",
"S"
],
"chemical_system": "Ba-Hf-S",
"density": 5.6163040726870035,
"density_atomic": 0.04104513180243613,
"volume": 487.26850473441414,
"volume_molar": 14.671997617126841,
"formula_full": "Ba4 Hf4 S12",
"formula_reduced": "BaHfS3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.922889794,
"spacegroup": 62
},
{
"id": "jvasp-102975",
"created_at": "2022-09-04T14:36:50.907734Z",
"updated_at": "2022-09-04T14:36:50.907758Z",
"structure_string": "Pr1 Eu1 Zn2\n1.0\n4.473236 -0.000000 2.582624\n1.491079 4.217407 2.582624\n-0.000000 -0.000000 5.165249\nPr Eu Zn\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Pr\n0.500000 0.500000 0.499999 Eu\n0.250000 0.250000 0.249999 Zn\n0.750001 0.750001 0.749998 Zn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pr",
"Eu",
"Zn"
],
"chemical_system": "Eu-Pr-Zn",
"density": 7.220019396849872,
"density_atomic": 0.041048888603047985,
"volume": 97.44478196915152,
"volume_molar": 14.67065483364351,
"formula_full": "Pr1 Eu1 Zn2",
"formula_reduced": "PrEuZn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-39966",
"created_at": "2022-09-04T14:37:55.457452Z",
"updated_at": "2022-09-04T14:37:55.457473Z",
"structure_string": "Nd1 Mg1 Cd2\n1.0\n-0.000000 3.652334 3.652334\n3.652334 0.000000 3.652334\n3.652334 3.652334 -0.000000\nNd Mg Cd\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Nd\n0.250000 0.250000 0.250000 Mg\n0.000000 0.000000 0.000000 Cd\n0.500000 0.500000 0.500000 Cd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Nd",
"Mg",
"Cd"
],
"chemical_system": "Cd-Mg-Nd",
"density": 6.703595101449917,
"density_atomic": 0.04105050811114133,
"volume": 97.4409376169056,
"volume_molar": 14.670076052884612,
"formula_full": "Nd1 Mg1 Cd2",
"formula_reduced": "NdMgCd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-40555",
"created_at": "2022-09-04T14:38:05.693578Z",
"updated_at": "2022-09-04T14:38:05.693594Z",
"structure_string": "Ac2 Au6\n1.0\n3.434544 -5.948806 -0.000000\n3.434544 5.948806 0.000000\n0.000000 -0.000000 4.769116\nAc Au\n2 6\ndirect\n0.333332 0.666667 0.250000 Ac\n0.666667 0.333332 0.750001 Ac\n0.703716 0.851857 0.750001 Au\n0.148142 0.296283 0.750001 Au\n0.148141 0.851858 0.750001 Au\n0.296283 0.148142 0.250000 Au\n0.851857 0.703716 0.250000 Au\n0.851858 0.148141 0.250000 Au\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ac",
"Au"
],
"chemical_system": "Ac-Au",
"density": 13.938382343516732,
"density_atomic": 0.0410509502570901,
"volume": 194.87977622681908,
"volume_molar": 14.669918046440078,
"formula_full": "Ac2 Au6",
"formula_reduced": "AcAu3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.3142681774999999,
"spacegroup": 194
},
{
"id": "jvasp-100871",
"created_at": "2022-09-04T14:36:46.963264Z",
"updated_at": "2022-09-04T14:36:46.963284Z",
"structure_string": "Y2 Ag2 Se4\n1.0\n5.127342 -0.007292 -2.172109\n-0.969216 5.194830 -2.305602\n0.077481 -0.067861 7.321007\nY Ag Se\n2 2 4\ndirect\n0.010008 0.001458 0.023787 Y\n0.255102 0.765697 0.513981 Y\n0.485705 0.588543 0.974955 Ag\n0.706316 0.091874 0.416648 Ag\n0.775126 0.720091 0.553997 Se\n0.246593 0.249595 0.497075 Se\n0.492499 0.068589 0.988740 Se\n0.019972 0.524221 0.043604 Se\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Y",
"Ag",
"Se"
],
"chemical_system": "Ag-Se-Y",
"density": 6.044615525918577,
"density_atomic": 0.04105118261751805,
"volume": 194.87867315632718,
"volume_molar": 14.669835010867946,
"formula_full": "Y2 Ag2 Se4",
"formula_reduced": "YAgSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.0367898608333332,
"spacegroup": 8
},
{
"id": "jvasp-78315",
"created_at": "2022-09-04T14:37:13.894545Z",
"updated_at": "2022-09-04T14:37:13.894567Z",
"structure_string": "Ca1 Zn1\n1.0\n3.652294 -0.000000 0.000000\n-0.000000 3.652294 0.000000\n-0.000000 -0.000000 3.652294\nCa Zn\n1 1\ndirect\n0.000000 0.000000 0.000000 Ca\n0.499999 0.499999 0.499999 Zn\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ca",
"Zn"
],
"chemical_system": "Ca-Zn",
"density": 3.595430095545668,
"density_atomic": 0.04105185688397393,
"volume": 48.718868080746226,
"volume_molar": 14.66959406250624,
"formula_full": "Ca1 Zn1",
"formula_reduced": "CaZn",
"formula_anonymous": "AB",
"energy_above_hull": 0.3486136363636364,
"spacegroup": 221
},
{
"id": "jvasp-37384",
"created_at": "2022-09-04T14:37:58.904429Z",
"updated_at": "2022-09-04T14:37:58.904444Z",
"structure_string": "Tm1 Mg2 Sc1\n1.0\n0.000000 3.652277 3.652277\n3.652277 0.000000 3.652277\n3.652277 3.652277 -0.000000\nTm Mg Sc\n1 2 1\ndirect\n0.750001 0.750001 0.750001 Tm\n0.000000 0.000000 0.000000 Mg\n0.499999 0.499999 0.499999 Mg\n0.249999 0.249999 0.249999 Sc\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tm",
"Mg",
"Sc"
],
"chemical_system": "Mg-Sc-Tm",
"density": 4.4736034673330645,
"density_atomic": 0.04105243013032031,
"volume": 97.43637556417637,
"volume_molar": 14.669389219792365,
"formula_full": "Tm1 Mg2 Sc1",
"formula_reduced": "TmMg2Sc",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5545569,
"spacegroup": 225
},
{
"id": "jvasp-104780",
"created_at": "2022-09-04T14:36:30.811022Z",
"updated_at": "2022-09-04T14:36:30.811046Z",
"structure_string": "Ba2 Cd1 N2\n1.0\n4.020899 0.000000 -1.173744\n-0.342557 4.006289 -1.173499\n0.021261 0.022757 7.546910\nBa Cd N\n2 1 2\ndirect\n0.840042 0.840043 0.180084 Ba\n0.159957 0.159958 0.819917 Ba\n0.500000 0.500000 0.500000 Cd\n0.350559 0.350559 0.201118 N\n0.649440 0.649441 0.798882 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ba",
"Cd",
"N"
],
"chemical_system": "Ba-Cd-N",
"density": 5.65941942671283,
"density_atomic": 0.041054678368377055,
"volume": 121.78879968650104,
"volume_molar": 14.668585894071065,
"formula_full": "Ba2 Cd1 N2",
"formula_reduced": "Ba2CdN2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.597227638,
"spacegroup": 139
},
{
"id": "jvasp-91878",
"created_at": "2022-09-04T14:36:01.987650Z",
"updated_at": "2022-09-04T14:36:01.987680Z",
"structure_string": "Y1 Mg7\n1.0\n6.618014 -0.000000 0.000000\n-3.309008 5.731367 -0.000000\n-0.000000 -0.000000 5.137178\nY Mg\n1 7\ndirect\n0.166667 0.333333 0.250000 Y\n0.173641 0.836820 0.250000 Mg\n0.663180 0.326359 0.250000 Mg\n0.663180 0.836820 0.250000 Mg\n0.335766 0.164234 0.750000 Mg\n0.335766 0.671535 0.750000 Mg\n0.828464 0.164234 0.750000 Mg\n0.833332 0.666667 0.750000 Mg\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Y",
"Mg"
],
"chemical_system": "Mg-Y",
"density": 2.2075311452506607,
"density_atomic": 0.0410562682862649,
"volume": 194.8545333984079,
"volume_molar": 14.668017848116671,
"formula_full": "Y1 Mg7",
"formula_reduced": "YMg7",
"formula_anonymous": "AB7",
"energy_above_hull": 0.0,
"spacegroup": 187
}
]
}