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&page=934",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density&page=932",
"results": [
{
"id": "jvasp-4831",
"created_at": "2022-09-04T14:36:34.926942Z",
"updated_at": "2022-09-04T14:36:34.926963Z",
"structure_string": "Sr4 Si2\n1.0\n2.699244 -4.675229 0.000000\n2.699244 4.675229 0.000000\n0.000000 0.000000 7.437674\nSr Si\n4 2\ndirect\n0.666666 0.333332 0.250000 Sr\n0.333332 0.666666 0.750000 Sr\n0.000000 0.000000 0.500000 Sr\n0.000000 0.000000 0.000000 Sr\n0.333332 0.666666 0.250000 Si\n0.666666 0.333332 0.750000 Si\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Sr",
"Si"
],
"chemical_system": "Si-Sr",
"density": 3.5971518763305816,
"density_atomic": 0.03196237797302403,
"volume": 187.72070103995227,
"volume_molar": 18.841341420474514,
"formula_full": "Sr4 Si2",
"formula_reduced": "Sr2Si",
"formula_anonymous": "AB2",
"energy_above_hull": 0.4635837399999997,
"spacegroup": 194
},
{
"id": "jvasp-116048",
"created_at": "2022-09-04T14:38:40.686948Z",
"updated_at": "2022-09-04T14:38:40.686981Z",
"structure_string": "Sr1 N1 F2\n1.0\n3.673363 0.000000 0.000000\n0.000000 3.673363 0.000000\n0.000000 0.000000 4.776491\nSr N F\n1 1 2\ndirect\n0.499999 0.499999 0.502670 Sr\n0.000000 0.000000 0.002274 N\n0.000000 0.000000 0.502322 F\n0.499999 0.499999 0.002734 F\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"N",
"F"
],
"chemical_system": "F-N-Sr",
"density": 3.5972529677843172,
"density_atomic": 0.06206165218842042,
"volume": 64.45203856088007,
"volume_molar": 9.70348121206419,
"formula_full": "Sr1 N1 F2",
"formula_reduced": "SrNF2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7005175312499998,
"spacegroup": 123
},
{
"id": "jvasp-32400",
"created_at": "2022-09-04T14:37:04.526389Z",
"updated_at": "2022-09-04T14:37:04.526405Z",
"structure_string": "Ru2 O8\n1.0\n4.211772 -0.000056 1.219331\n1.961428 4.596332 1.107805\n0.001405 0.013135 7.874014\nRu O\n2 8\ndirect\n0.243656 0.749951 0.249992 Ru\n0.756343 0.250049 0.750008 Ru\n0.900552 0.810704 0.425758 O\n0.412429 0.546234 0.692292 O\n0.136958 0.689241 0.074210 O\n0.587568 0.453768 0.307708 O\n0.650820 0.953905 0.807711 O\n0.863041 0.310760 0.925791 O\n0.349178 0.046094 0.192289 O\n0.099449 0.189295 0.574241 O\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Ru",
"O"
],
"chemical_system": "O-Ru",
"density": 3.597274629460098,
"density_atomic": 0.06561946190067562,
"volume": 152.39381290776845,
"volume_molar": 9.177369922836865,
"formula_full": "Ru2 O8",
"formula_reduced": "RuO4",
"formula_anonymous": "AB4",
"energy_above_hull": 2.8604009000000006,
"spacegroup": 15
},
{
"id": "jvasp-95286",
"created_at": "2022-09-04T14:36:04.862083Z",
"updated_at": "2022-09-04T14:36:04.862116Z",
"structure_string": "Sr4 Li4 B4 O12\n1.0\n6.083266 0.000000 -2.194235\n0.000000 6.733810 0.000000\n-0.017395 0.000000 6.919157\nSr Li B O\n4 4 4 12\ndirect\n0.197834 0.124411 0.864874 Sr\n0.802166 0.875589 0.135126 Sr\n0.697835 0.375589 0.364874 Sr\n0.302165 0.624411 0.635126 Sr\n0.601621 0.090925 0.694689 Li\n0.898379 0.590925 0.805311 Li\n0.398379 0.909075 0.305311 Li\n0.101621 0.409075 0.194689 Li\n0.189910 0.135737 0.426076 B\n0.689910 0.364263 0.926075 B\n0.810090 0.864263 0.573924 B\n0.310090 0.635737 0.073924 B\n0.840330 0.886339 0.782700 O\n0.392559 0.801134 0.007256 O\n0.159669 0.113661 0.217300 O\n0.340330 0.613660 0.282700 O\n0.804217 0.509916 0.062395 O\n0.304216 0.990084 0.562395 O\n0.195783 0.490084 0.937605 O\n0.892559 0.698865 0.507256 O\n0.107441 0.301135 0.492744 O\n0.659669 0.386339 0.717300 O\n0.695783 0.009916 0.437604 O\n0.607441 0.198865 0.992744 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Sr",
"Li",
"B",
"O"
],
"chemical_system": "B-Li-O-Sr",
"density": 3.5974372283474954,
"density_atomic": 0.08475286609208146,
"volume": 283.1762641976581,
"volume_molar": 7.105530512038523,
"formula_full": "Sr4 Li4 B4 O12",
"formula_reduced": "SrLiBO3",
"formula_anonymous": "ABCD3",
"energy_above_hull": 1.7115065655555557,
"spacegroup": 14
},
{
"id": "jvasp-122000",
"created_at": "2022-09-04T14:38:50.938987Z",
"updated_at": "2022-09-04T14:38:50.939016Z",
"structure_string": "Mg2 Ti2 Si4 O12\n1.0\n6.485285 0.129100 1.095134\n0.353517 6.476930 1.095134\n-0.189773 -0.183314 4.875072\nMg Ti Si O\n2 2 4 12\ndirect\n0.723855 0.276146 0.749999 Mg\n0.276146 0.723855 0.249999 Mg\n0.930123 0.069878 0.249999 Ti\n0.069879 0.930122 0.749999 Ti\n0.402130 0.209954 0.287907 Si\n0.790047 0.597871 0.212091 Si\n0.209954 0.402130 0.787907 Si\n0.597872 0.790047 0.712090 Si\n0.760455 0.966568 0.648059 O\n0.033433 0.239546 0.851939 O\n0.146545 0.623686 0.631320 O\n0.376315 0.853456 0.868677 O\n0.853456 0.376314 0.368677 O\n0.700630 0.582354 0.906892 O\n0.299371 0.417646 0.093105 O\n0.582355 0.700630 0.406893 O\n0.239546 0.033432 0.351939 O\n0.417647 0.299371 0.593105 O\n0.623686 0.146545 0.131321 O\n0.966569 0.760454 0.148059 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Mg",
"Ti",
"Si",
"O"
],
"chemical_system": "Mg-O-Si-Ti",
"density": 3.5974642143710613,
"density_atomic": 0.09656991097191182,
"volume": 207.10384630899338,
"volume_molar": 6.236042572050823,
"formula_full": "Mg2 Ti2 Si4 O12",
"formula_reduced": "MgTi(SiO3)2",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.5557875583333334,
"spacegroup": 15
},
{
"id": "jvasp-65745",
"created_at": "2022-09-04T14:35:44.897781Z",
"updated_at": "2022-09-04T14:35:44.897806Z",
"structure_string": "Ba1 Ca2 Sn1\n1.0\n4.248662 0.000000 0.000000\n0.000000 4.248662 -0.000000\n0.000000 -0.000000 8.596681\nBa Ca Sn\n1 2 1\ndirect\n0.500000 0.500000 0.704606 Ba\n0.000000 0.000000 0.045948 Ca\n0.500000 0.500000 0.297091 Ca\n0.000000 0.000000 0.452355 Sn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Ca",
"Sn"
],
"chemical_system": "Ba-Ca-Sn",
"density": 3.5975147871600974,
"density_atomic": 0.025776551495059585,
"volume": 155.1797958996436,
"volume_molar": 23.362864350393117,
"formula_full": "Ba1 Ca2 Sn1",
"formula_reduced": "BaCa2Sn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 99
},
{
"id": "jvasp-78799",
"created_at": "2022-09-04T14:37:15.837702Z",
"updated_at": "2022-09-04T14:37:15.837720Z",
"structure_string": "Ca2 Zn2\n1.0\n5.158484 0.000000 -0.000000\n0.000000 3.659087 0.000000\n0.000000 0.000000 5.159062\nCa Zn\n2 2\ndirect\n0.749999 0.000000 0.250001 Ca\n0.250000 0.000000 0.749999 Ca\n0.250000 0.500000 0.249900 Zn\n0.749999 0.500000 0.750100 Zn\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ca",
"Zn"
],
"chemical_system": "Ca-Zn",
"density": 3.5975965987790777,
"density_atomic": 0.04107659355756044,
"volume": 97.3790583290413,
"volume_molar": 14.66075990834343,
"formula_full": "Ca2 Zn2",
"formula_reduced": "CaZn",
"formula_anonymous": "AB",
"energy_above_hull": 0.3484686363636363,
"spacegroup": 221
},
{
"id": "jvasp-43681",
"created_at": "2022-09-04T14:37:56.610511Z",
"updated_at": "2022-09-04T14:37:56.610547Z",
"structure_string": "Li2 V4 O2 F10\n1.0\n0.000000 5.429698 0.012592\n4.997218 0.000000 0.000000\n0.000000 -0.720494 -7.479946\nLi V O F\n2 4 2 10\ndirect\n0.087844 0.518079 0.213562 Li\n0.087844 0.481921 0.713562 Li\n0.006690 0.981697 0.490729 V\n0.489788 0.484450 0.997199 V\n0.489788 0.515550 0.497199 V\n0.006691 0.018303 0.990730 V\n0.200703 0.699596 0.447862 O\n0.200704 0.300404 0.947863 O\n0.296112 0.207113 0.580817 F\n0.820946 0.320469 0.568292 F\n0.494045 0.366628 0.253467 F\n0.494045 0.633373 0.753468 F\n-0.004704 0.845990 0.746858 F\n0.296111 0.792888 0.080817 F\n0.688608 0.817608 0.421820 F\n0.688609 0.182392 0.921820 F\n0.820945 0.679532 0.068291 F\n-0.004704 0.154010 0.246858 F\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Li",
"V",
"O",
"F"
],
"chemical_system": "F-Li-O-V",
"density": 3.5977570432687993,
"density_atomic": 0.08870888021839264,
"volume": 202.91091439420438,
"volume_molar": 6.788656045678938,
"formula_full": "Li2 V4 O2 F10",
"formula_reduced": "LiV2OF5",
"formula_anonymous": "ABC2D5",
"energy_above_hull": 1.1326981458333332,
"spacegroup": 7
},
{
"id": "jvasp-116012",
"created_at": "2022-09-04T14:38:40.697832Z",
"updated_at": "2022-09-04T14:38:40.697856Z",
"structure_string": "Li1 Mn1 F4\n1.0\n3.137586 -3.276753 0.000000\n3.137586 3.276753 0.000000\n0.000000 0.000000 3.094690\nLi Mn F\n1 1 4\ndirect\n0.000000 0.000000 0.499999 Li\n0.500001 0.500001 0.000000 Mn\n0.791117 0.791117 0.000000 F\n0.697101 0.302902 0.499999 F\n0.208886 0.208886 0.000000 F\n0.302902 0.697101 0.499999 F\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Li",
"Mn",
"F"
],
"chemical_system": "F-Li-Mn",
"density": 3.5978309519026217,
"density_atomic": 0.09428980963851372,
"volume": 63.633599675327304,
"volume_molar": 6.386841571838523,
"formula_full": "Li1 Mn1 F4",
"formula_reduced": "LiMnF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.3455347285632184,
"spacegroup": 65
},
{
"id": "jvasp-114513",
"created_at": "2022-09-04T14:38:41.437323Z",
"updated_at": "2022-09-04T14:38:41.437346Z",
"structure_string": "Ti1 B1 O4\n1.0\n2.519092 -3.321748 0.000000\n2.519092 3.321748 0.000000\n0.000000 0.000000 3.382838\nTi B O\n1 1 4\ndirect\n0.500000 0.500000 0.500000 Ti\n0.000000 0.000000 0.000000 B\n0.260317 0.260317 0.000000 O\n0.219716 0.780284 0.500000 O\n0.780284 0.219716 0.500000 O\n0.739683 0.739683 0.000000 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ti",
"B",
"O"
],
"chemical_system": "B-O-Ti",
"density": 3.59820067945896,
"density_atomic": 0.10598132464117296,
"volume": 56.6137479439377,
"volume_molar": 5.682265984492558,
"formula_full": "Ti1 B1 O4",
"formula_reduced": "TiBO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.984849152777778,
"spacegroup": 65
},
{
"id": "jvasp-114605",
"created_at": "2022-09-04T14:38:41.444946Z",
"updated_at": "2022-09-04T14:38:41.444971Z",
"structure_string": "Ca1 Be1 Sn1\n1.0\n5.177356 -0.000000 -0.000000\n-2.588678 4.483722 0.000000\n-0.000000 -0.000000 3.335820\nCa Be Sn\n1 1 1\ndirect\n0.333333 0.666667 -0.000000 Ca\n0.000000 0.000000 0.000000 Be\n0.666667 0.333333 0.000000 Sn\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ca",
"Be",
"Sn"
],
"chemical_system": "Be-Ca-Sn",
"density": 3.5982572632046046,
"density_atomic": 0.038741099346123915,
"volume": 77.43714170827093,
"volume_molar": 15.544578913975812,
"formula_full": "Ca1 Be1 Sn1",
"formula_reduced": "CaBeSn",
"formula_anonymous": "ABC",
"energy_above_hull": 0.6665394066666667,
"spacegroup": 187
},
{
"id": "jvasp-87040",
"created_at": "2022-09-04T14:35:47.256153Z",
"updated_at": "2022-09-04T14:35:47.256181Z",
"structure_string": "V2 P8\n1.0\n4.782519 -0.016382 2.287103\n1.889190 5.505504 0.903451\n0.008852 -0.008190 6.125363\nV P\n2 8\ndirect\n0.062385 0.250000 0.875229 V\n0.937614 0.750000 0.124770 V\n0.497260 0.310428 0.555143 P\n0.947596 0.189572 0.555143 P\n0.185767 0.323524 0.178240 P\n0.635994 0.176476 0.178240 P\n0.814232 0.676476 0.821759 P\n0.364006 0.823524 0.821759 P\n0.052404 0.810427 0.444856 P\n0.502740 0.689572 0.444856 P\n",
"nsites": 10,
"nelements": 2,
"elements": [
"V",
"P"
],
"chemical_system": "P-V",
"density": 3.598452450238688,
"density_atomic": 0.06197327569345827,
"volume": 161.35987468959257,
"volume_molar": 9.717318783966878,
"formula_full": "V2 P8",
"formula_reduced": "VP4",
"formula_anonymous": "AB4",
"energy_above_hull": 3.39064324,
"spacegroup": 15
}
]
}