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=650",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density_atomic&page=648",
"results": [
{
"id": "jvasp-24643",
"created_at": "2022-09-04T14:37:14.967719Z",
"updated_at": "2022-09-04T14:37:14.967739Z",
"structure_string": "Ac2 Cl6\n1.0\n3.810395 -6.599798 0.000000\n3.810395 6.599798 0.000000\n-0.000000 0.000000 4.560338\nAc Cl\n2 6\ndirect\n0.333332 0.666666 0.750000 Ac\n0.666666 0.333332 0.250000 Ac\n0.913416 0.615083 0.750000 Cl\n0.298331 0.913417 0.250000 Cl\n0.086582 0.384915 0.250000 Cl\n0.701668 0.086582 0.750000 Cl\n0.384915 0.298332 0.750000 Cl\n0.615084 0.701667 0.250000 Cl\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ac",
"Cl"
],
"chemical_system": "Ac-Cl",
"density": 4.8268478304703875,
"density_atomic": 0.03487886281424957,
"volume": 229.36527611593013,
"volume_molar": 17.265874727829967,
"formula_full": "Ac2 Cl6",
"formula_reduced": "AcCl3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 176
},
{
"id": "jvasp-117650",
"created_at": "2022-09-04T14:38:36.350757Z",
"updated_at": "2022-09-04T14:38:36.350782Z",
"structure_string": "Ca1 Be1 P1\n1.0\n3.618053 -0.974905 0.000000\n-0.474232 5.439674 0.000000\n0.000000 0.000000 4.475148\nCa Be P\n1 1 1\ndirect\n0.098158 0.427416 0.000000 Ca\n0.381724 -0.005383 0.000000 Be\n-0.192465 -0.153776 0.000000 P\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ca",
"Be",
"P"
],
"chemical_system": "Be-Ca-P",
"density": 1.5458050415759768,
"density_atomic": 0.03488107787110212,
"volume": 86.0065165155176,
"volume_molar": 17.264778291123722,
"formula_full": "Ca1 Be1 P1",
"formula_reduced": "CaBeP",
"formula_anonymous": "ABC",
"energy_above_hull": 1.22875734,
"spacegroup": 38
},
{
"id": "jvasp-17209",
"created_at": "2022-09-04T14:38:14.860491Z",
"updated_at": "2022-09-04T14:38:14.860517Z",
"structure_string": "Ba1 Al1 Ge1\n1.0\n2.191251 -3.795360 0.000000\n2.191251 3.795360 -0.000000\n-0.000000 -0.000000 5.170672\nBa Al Ge\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Ba\n0.666667 0.333333 0.500000 Al\n0.333333 0.666667 0.500000 Ge\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Al",
"Ge"
],
"chemical_system": "Al-Ba-Ge",
"density": 4.574894079799316,
"density_atomic": 0.03488182237748109,
"volume": 86.00468082013776,
"volume_molar": 17.264409797258065,
"formula_full": "Ba1 Al1 Ge1",
"formula_reduced": "BaAlGe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.47590824,
"spacegroup": 187
},
{
"id": "jvasp-106696",
"created_at": "2022-09-04T14:36:50.787454Z",
"updated_at": "2022-09-04T14:36:50.787479Z",
"structure_string": "Y1 Tm1 Te2\n1.0\n4.329085 -0.000000 0.000000\n0.000000 4.329085 0.000000\n-0.000000 0.000000 6.118589\nY Tm Te\n1 1 2\ndirect\n0.500001 0.500001 -0.000000 Y\n0.000000 0.000000 0.500000 Tm\n0.000000 0.000000 0.000000 Te\n0.500001 0.500001 0.500000 Te\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Y",
"Tm",
"Te"
],
"chemical_system": "Te-Tm-Y",
"density": 7.429453474269232,
"density_atomic": 0.0348832132971308,
"volume": 114.66833533735857,
"volume_molar": 17.263721402911386,
"formula_full": "Y1 Tm1 Te2",
"formula_reduced": "YTmTe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.1940088083333331,
"spacegroup": 123
},
{
"id": "jvasp-29026",
"created_at": "2022-09-04T14:36:01.800694Z",
"updated_at": "2022-09-04T14:36:01.800720Z",
"structure_string": "Te4 Mo1 W3 Se4\n1.0\n3.444449 0.000000 -0.000000\n-1.722224 2.982413 -0.009599\n-0.000000 -0.108262 33.482011\nTe Mo W Se\n4 1 3 4\ndirect\n0.336580 0.673158 0.734083 Te\n0.665508 0.331014 0.018101 Te\n0.669344 0.338687 0.129171 Te\n0.332410 0.664818 0.622466 Te\n0.334088 0.668174 0.073604 Mo\n0.328283 0.656565 0.472463 W\n0.669790 0.339578 0.278535 W\n0.667815 0.335630 0.678317 W\n0.338378 0.676755 0.327580 Se\n0.659501 0.319000 0.423395 Se\n0.663653 0.327305 0.521571 Se\n0.334658 0.669313 0.229461 Se\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Te",
"Mo",
"W",
"Se"
],
"chemical_system": "Mo-Se-Te-W",
"density": 7.1148151872106355,
"density_atomic": 0.03488885272734615,
"volume": 343.9494010817475,
"volume_molar": 17.260930896933164,
"formula_full": "Te4 Mo1 W3 Se4",
"formula_reduced": "Te4MoW3Se4",
"formula_anonymous": "AB3C4D4",
"energy_above_hull": 3.939248369444445,
"spacegroup": 156
},
{
"id": "jvasp-100095",
"created_at": "2022-09-04T14:36:38.929925Z",
"updated_at": "2022-09-04T14:36:38.929952Z",
"structure_string": "Rb2 Nd1 Cu1 Cl6\n1.0\n6.409200 -0.000000 3.700354\n2.136400 6.042652 3.700354\n0.000000 0.000000 7.400707\nRb Nd Cu Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Nd\n0.000000 0.000000 0.000000 Cu\n0.759191 0.240809 0.240809 Cl\n0.240809 0.240809 0.759191 Cl\n0.240809 0.759190 0.759191 Cl\n0.240809 0.759190 0.240809 Cl\n0.759191 0.240809 0.759190 Cl\n0.759191 0.759190 0.240809 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Nd",
"Cu",
"Cl"
],
"chemical_system": "Cl-Cu-Nd-Rb",
"density": 3.4265442715649357,
"density_atomic": 0.034889551108455624,
"volume": 286.6187635637553,
"volume_molar": 17.260585386380935,
"formula_full": "Rb2 Nd1 Cu1 Cl6",
"formula_reduced": "Rb2NdCuCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-100769",
"created_at": "2022-09-04T14:37:08.805873Z",
"updated_at": "2022-09-04T14:37:08.805893Z",
"structure_string": "Rb4 Ni2 As4\n1.0\n7.838432 -0.069905 0.000000\n-4.802603 6.195233 0.000000\n0.000000 -0.000000 5.943161\nRb Ni As\n4 2 4\ndirect\n0.791445 0.208556 0.250000 Rb\n0.208556 0.791444 0.750000 Rb\n0.404280 0.595720 0.250000 Rb\n0.595720 0.404280 0.750000 Rb\n0.000000 0.000000 0.000000 Ni\n0.000000 0.000000 0.500000 Ni\n0.918115 0.721650 0.250000 As\n0.081885 0.278350 0.750000 As\n0.278351 0.081885 0.250000 As\n0.721650 0.918115 0.750000 As\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Rb",
"Ni",
"As"
],
"chemical_system": "As-Ni-Rb",
"density": 4.3971131946508555,
"density_atomic": 0.03489061201978915,
"volume": 286.6100484086731,
"volume_molar": 17.260060547474435,
"formula_full": "Rb4 Ni2 As4",
"formula_reduced": "Rb2NiAs2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.7167991799999999,
"spacegroup": 63
},
{
"id": "jvasp-114602",
"created_at": "2022-09-04T14:38:42.189946Z",
"updated_at": "2022-09-04T14:38:42.189982Z",
"structure_string": "Ca1 Be1 Se1\n1.0\n5.864307 0.820852 0.000000\n0.642654 3.613346 0.000000\n0.000000 0.000000 4.161050\nCa Be Se\n1 1 1\ndirect\n0.430385 -0.257256 0.000000 Ca\n-0.181162 0.048504 0.000000 Be\n0.022804 0.446526 0.000000 Se\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ca",
"Be",
"Se"
],
"chemical_system": "Be-Ca-Se",
"density": 2.4731407105902066,
"density_atomic": 0.0348931987076931,
"volume": 85.97664046599927,
"volume_molar": 17.258781031938653,
"formula_full": "Ca1 Be1 Se1",
"formula_reduced": "CaBeSe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.6782332955555557,
"spacegroup": 38
},
{
"id": "jvasp-109598",
"created_at": "2022-09-04T14:38:20.368245Z",
"updated_at": "2022-09-04T14:38:20.368276Z",
"structure_string": "Sr1 In3\n1.0\n4.857725 -0.000000 0.000000\n0.000000 4.857725 0.000000\n0.000000 -0.000000 4.857725\nSr In\n1 3\ndirect\n0.000000 0.000000 0.000000 Sr\n-0.000000 0.500000 0.500000 In\n0.500000 0.000000 0.500000 In\n0.500000 0.500000 -0.000000 In\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sr",
"In"
],
"chemical_system": "In-Sr",
"density": 6.2590504886490015,
"density_atomic": 0.034894840309407114,
"volume": 114.63012767883798,
"volume_molar": 17.257969105468362,
"formula_full": "Sr1 In3",
"formula_reduced": "SrIn3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0123087499999999,
"spacegroup": 221
},
{
"id": "jvasp-86814",
"created_at": "2022-09-04T14:36:03.356033Z",
"updated_at": "2022-09-04T14:36:03.356053Z",
"structure_string": "Ba1 Ag2 Sn1 Se4\n1.0\n6.255230 -0.008008 -2.423577\n-3.626766 5.462317 -1.418134\n0.007264 0.008008 6.708322\nBa Ag Sn Se\n1 2 1 4\ndirect\n-0.000000 -0.000000 -0.000000 Ba\n0.500000 0.821330 0.321330 Ag\n0.500000 0.178670 0.678670 Ag\n0.000001 0.500000 0.500001 Sn\n0.010357 0.531290 0.127656 Se\n0.403631 0.882701 0.872343 Se\n0.989641 0.117299 0.520931 Se\n0.596367 0.468711 0.479068 Se\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Ba",
"Ag",
"Sn",
"Se"
],
"chemical_system": "Ag-Ba-Se-Sn",
"density": 5.704885678885048,
"density_atomic": 0.03489592695078726,
"volume": 229.2531163101692,
"volume_molar": 17.257431701106135,
"formula_full": "Ba1 Ag2 Sn1 Se4",
"formula_reduced": "BaAg2SnSe4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 0.6628232070833333,
"spacegroup": 23
},
{
"id": "jvasp-86212",
"created_at": "2022-09-04T14:36:02.890510Z",
"updated_at": "2022-09-04T14:36:02.890536Z",
"structure_string": "Ba1 Ag2 Sn1 Se4\n1.0\n6.255259 -0.007954 -2.423447\n-3.626809 5.462200 -1.418245\n0.007396 0.007954 6.708303\nBa Ag Sn Se\n1 2 1 4\ndirect\n0.000000 0.000000 0.000000 Ba\n0.500000 0.821338 0.321337 Ag\n0.500001 0.178662 0.678662 Ag\n0.000003 0.500000 0.500003 Sn\n0.010369 0.531278 0.127661 Se\n0.403612 0.882703 0.872333 Se\n0.989631 0.117297 0.520909 Se\n0.596385 0.468722 0.479090 Se\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Ba",
"Ag",
"Sn",
"Se"
],
"chemical_system": "Ag-Ba-Se-Sn",
"density": 5.704945247479834,
"density_atomic": 0.034896291322914816,
"volume": 229.25072254732015,
"volume_molar": 17.257251506395846,
"formula_full": "Ba1 Ag2 Sn1 Se4",
"formula_reduced": "BaAg2SnSe4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 0.6628282070833333,
"spacegroup": 23
},
{
"id": "jvasp-8202",
"created_at": "2022-09-04T14:38:10.238265Z",
"updated_at": "2022-09-04T14:38:10.238290Z",
"structure_string": "Sr1 Sn2 As2\n1.0\n4.162438 0.001245 8.420184\n1.968560 3.667514 8.420184\n0.002081 0.001245 9.392836\nSr Sn As\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.210417 0.210416 0.210417 Sn\n0.789585 0.789580 0.789584 Sn\n0.594730 0.594727 0.594730 As\n0.405272 0.405269 0.405271 As\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sr",
"Sn",
"As"
],
"chemical_system": "As-Sn-Sr",
"density": 5.503686538389336,
"density_atomic": 0.03489697576641117,
"volume": 143.27889137065483,
"volume_molar": 17.256913035416655,
"formula_full": "Sr1 Sn2 As2",
"formula_reduced": "Sr(SnAs)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.9229486419999996,
"spacegroup": 166
}
]
}