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=-energy_above_hull&page=4475",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=4473",
"results": [
{
"id": "jvasp-117779",
"created_at": "2022-09-04T14:38:47.878966Z",
"updated_at": "2022-09-04T14:38:47.878994Z",
"structure_string": "Cd1 Se1 Br2\n1.0\n4.010707 -0.000000 0.000000\n0.000000 4.010707 0.000000\n0.000000 0.000000 7.458761\nCd Se Br\n1 1 2\ndirect\n0.500001 0.500001 0.429599 Cd\n-0.000000 -0.000000 0.018656 Se\n-0.000000 -0.000000 0.515930 Br\n0.500001 0.500001 0.045816 Br\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Cd",
"Se",
"Br"
],
"chemical_system": "Br-Cd-Se",
"density": 4.860367094520703,
"density_atomic": 0.03333891240488859,
"volume": 119.97991870345076,
"volume_molar": 18.06339897013843,
"formula_full": "Cd1 Se1 Br2",
"formula_reduced": "CdSeBr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 99
},
{
"id": "jvasp-116525",
"created_at": "2022-09-04T14:38:43.515976Z",
"updated_at": "2022-09-04T14:38:43.516004Z",
"structure_string": "K2 Hg2 Br6 O2\n1.0\n8.180117 -0.085363 0.000000\n-6.977048 4.271114 0.000000\n-0.000000 -0.000000 10.107012\nK Hg Br O\n2 2 6 2\ndirect\n0.758758 0.241243 0.329572 K\n0.241242 0.758757 0.829571 K\n-0.000010 0.000010 0.579827 Hg\n0.000010 -0.000010 0.079827 Hg\n0.844917 0.155084 0.632369 Br\n0.155083 0.844915 0.132369 Br\n0.845001 0.155000 0.026794 Br\n0.154999 0.845000 0.526794 Br\n0.539450 0.460550 0.829571 Br\n0.460550 0.539450 0.329571 Br\n0.346808 0.653192 0.329566 O\n0.653192 0.346808 0.829565 O\n",
"nsites": 12,
"nelements": 4,
"elements": [
"K",
"Hg",
"Br",
"O"
],
"chemical_system": "Br-Hg-K-O",
"density": 4.7400016617779155,
"density_atomic": 0.03457203210222983,
"volume": 347.10137849334063,
"volume_molar": 17.419111327307782,
"formula_full": "K2 Hg2 Br6 O2",
"formula_reduced": "KHgBr3O",
"formula_anonymous": "ABCD3",
"energy_above_hull": 0.0,
"spacegroup": 63
},
{
"id": "jvasp-117798",
"created_at": "2022-09-04T14:38:48.585582Z",
"updated_at": "2022-09-04T14:38:48.585601Z",
"structure_string": "I1 Br3\n1.0\n5.822527 -0.632427 -0.213850\n4.891228 -4.552760 0.982686\n-0.174135 1.406470 -6.701782\nI Br\n1 3\ndirect\n0.138656 0.559634 0.528508 I\n0.746153 0.164438 0.935176 Br\n0.392374 0.699832 0.292265 Br\n0.926496 0.428119 0.729745 Br\n",
"nsites": 4,
"nelements": 2,
"elements": [
"I",
"Br"
],
"chemical_system": "Br-I",
"density": 4.122216822402153,
"density_atomic": 0.02708505698756472,
"volume": 147.68290876539334,
"volume_molar": 22.234181610785914,
"formula_full": "I1 Br3",
"formula_reduced": "IBr3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 1
},
{
"id": "jvasp-116669",
"created_at": "2022-09-04T14:38:44.159630Z",
"updated_at": "2022-09-04T14:38:44.159656Z",
"structure_string": "Na3 Sm3 F12\n1.0\n5.471677 0.002683 2.598697\n1.778279 5.976196 3.290136\n-0.007596 -0.005676 7.057427\nNa Sm F\n3 3 12\ndirect\n0.666186 0.483646 0.166816 Na\n0.663651 0.005214 0.679680 Na\n0.330128 0.427548 0.908194 Na\n0.002646 0.999773 0.997680 Sm\n0.997670 0.499192 0.503337 Sm\n0.335585 0.921258 0.409075 Sm\n0.975950 0.887500 0.383682 F\n0.981418 0.381999 0.882157 F\n0.276747 0.130427 0.624005 F\n0.257383 0.625779 0.128924 F\n0.046869 0.819012 0.771047 F\n0.594865 0.166065 0.197839 F\n0.591833 0.708018 0.659158 F\n0.754763 0.735398 0.231624 F\n0.365303 0.541779 0.501452 F\n0.367547 0.007082 0.031973 F\n0.037671 0.279161 0.315261 F\n0.753788 0.244141 0.745109 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Na",
"Sm",
"F"
],
"chemical_system": "F-Na-Sm",
"density": 5.3786734632238735,
"density_atomic": 0.0779434250997977,
"volume": 230.93673362381813,
"volume_molar": 7.726297314095875,
"formula_full": "Na3 Sm3 F12",
"formula_reduced": "NaSmF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 1
},
{
"id": "jvasp-115723",
"created_at": "2022-09-04T14:38:44.832397Z",
"updated_at": "2022-09-04T14:38:44.832421Z",
"structure_string": "Rb3 S1 Br1\n1.0\n6.208092 0.000000 -0.000000\n-0.000000 6.208092 0.000000\n-0.000000 -0.000000 6.208092\nRb S Br\n3 1 1\ndirect\n0.500000 0.000000 0.500000 Rb\n0.500000 0.500000 0.000000 Rb\n0.000000 0.500000 0.500000 Rb\n0.500000 0.500000 0.500000 S\n0.000000 0.000000 0.000000 Br\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Rb",
"S",
"Br"
],
"chemical_system": "Br-Rb-S",
"density": 2.5565938993146204,
"density_atomic": 0.02089755955271147,
"volume": 239.26238790649828,
"volume_molar": 28.817435570933085,
"formula_full": "Rb3 S1 Br1",
"formula_reduced": "Rb3SBr",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-115857",
"created_at": "2022-09-04T14:38:40.393667Z",
"updated_at": "2022-09-04T14:38:40.393688Z",
"structure_string": "Tl1 Cd1 Te1\n1.0\n6.677202 -1.204790 0.000000\n-0.710229 4.442316 0.000000\n0.000000 0.000000 3.443113\nTl Cd Te\n1 1 1\ndirect\n-0.201356 -0.218515 0.000000 Tl\n0.457577 0.110982 0.000000 Cd\n0.165087 0.464923 0.000000 Te\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Tl",
"Cd",
"Te"
],
"chemical_system": "Cd-Te-Tl",
"density": 7.440032531373484,
"density_atomic": 0.030246735733374972,
"volume": 99.18425665648701,
"volume_molar": 19.91005182537772,
"formula_full": "Tl1 Cd1 Te1",
"formula_reduced": "TlCdTe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 38
},
{
"id": "jvasp-117764",
"created_at": "2022-09-04T14:38:47.698552Z",
"updated_at": "2022-09-04T14:38:47.698571Z",
"structure_string": "Rb1 Ca1 Br2\n1.0\n4.298747 0.000000 -0.000000\n0.000000 4.298747 -0.000000\n-0.000000 0.000000 8.276706\nRb Ca Br\n1 1 2\ndirect\n0.500000 0.500000 0.559362 Rb\n0.000000 -0.000000 0.032771 Ca\n0.000000 -0.000000 0.373024 Br\n0.500000 0.500000 0.044843 Br\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Rb",
"Ca",
"Br"
],
"chemical_system": "Br-Ca-Rb",
"density": 3.098071649874136,
"density_atomic": 0.026152830018811666,
"volume": 152.9471188059881,
"volume_molar": 23.02672695715259,
"formula_full": "Rb1 Ca1 Br2",
"formula_reduced": "RbCaBr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 99
},
{
"id": "jvasp-114772",
"created_at": "2022-09-04T14:38:43.597795Z",
"updated_at": "2022-09-04T14:38:43.597830Z",
"structure_string": "Na3 Cl1 O1\n1.0\n4.481476 -0.000000 0.000000\n-0.000000 4.481476 -0.000000\n0.000000 -0.000000 4.481476\nNa Cl O\n3 1 1\ndirect\n0.500001 0.000000 0.000000 Na\n0.000000 0.000000 0.500001 Na\n0.000000 0.500001 0.000000 Na\n0.500001 0.500001 0.500001 Cl\n0.000000 0.000000 0.000000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Na",
"Cl",
"O"
],
"chemical_system": "Cl-Na-O",
"density": 2.2217268047741623,
"density_atomic": 0.05555290567301895,
"volume": 90.00429301447701,
"volume_molar": 10.840370430749305,
"formula_full": "Na3 Cl1 O1",
"formula_reduced": "Na3ClO",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-115866",
"created_at": "2022-09-04T14:38:40.461669Z",
"updated_at": "2022-09-04T14:38:40.461692Z",
"structure_string": "Na1 I1 Cl1\n1.0\n3.540067 0.000000 0.000000\n-0.000000 3.540067 0.000000\n-0.000000 0.000000 8.873038\nNa I Cl\n1 1 1\ndirect\n0.000000 0.000000 0.005116 Na\n0.000000 0.000000 0.676892 I\n0.000000 0.000000 0.276504 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Na",
"I",
"Cl"
],
"chemical_system": "Cl-I-Na",
"density": 2.767833200160542,
"density_atomic": 0.02697900632684553,
"volume": 111.19757205493674,
"volume_molar": 22.32158103616905,
"formula_full": "Na1 I1 Cl1",
"formula_reduced": "NaICl",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 99
},
{
"id": "jvasp-113641",
"created_at": "2022-09-04T14:38:47.946431Z",
"updated_at": "2022-09-04T14:38:47.946453Z",
"structure_string": "Hg2 I1\n1.0\n7.162818 0.971782 0.769809\n-4.149952 -4.063809 0.002822\n-1.032671 1.067162 -4.129166\nHg I\n2 1\ndirect\n0.881501 0.176167 -0.020656 Hg\n0.214588 0.777986 0.646105 Hg\n0.548267 0.477292 0.312857 I\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Hg",
"I"
],
"chemical_system": "Hg-I",
"density": 9.05177158934719,
"density_atomic": 0.03096722915782141,
"volume": 96.87660412595514,
"volume_molar": 19.446818213243287,
"formula_full": "Hg2 I1",
"formula_reduced": "Hg2I",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0,
"spacegroup": 164
},
{
"id": "jvasp-110718",
"created_at": "2022-09-04T14:38:48.481966Z",
"updated_at": "2022-09-04T14:38:48.481988Z",
"structure_string": "Rb2 In1 As1 I6\n1.0\n7.362709 0.000000 4.250862\n2.454236 6.941629 4.250862\n-0.000000 0.000000 8.501724\nRb In As I\n2 1 1 6\ndirect\n0.750000 0.750000 0.749999 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.499999 In\n0.000000 0.000000 0.000000 As\n0.759263 0.240737 0.240737 I\n0.240737 0.240737 0.759262 I\n0.240738 0.759263 0.759262 I\n0.240738 0.759263 0.240737 I\n0.759263 0.240737 0.759262 I\n0.759263 0.759263 0.240737 I\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"In",
"As",
"I"
],
"chemical_system": "As-I-In-Rb",
"density": 4.288203677691847,
"density_atomic": 0.023014098275604435,
"volume": 434.51626391116395,
"volume_molar": 26.167181037823376,
"formula_full": "Rb2 In1 As1 I6",
"formula_reduced": "Rb2InAsI6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-112764",
"created_at": "2022-09-04T14:38:43.616542Z",
"updated_at": "2022-09-04T14:38:43.616550Z",
"structure_string": "Mg2 Co2 F10\n1.0\n4.786126 0.008383 1.759759\n1.001834 4.680107 1.759759\n-0.023392 -0.018948 7.053535\nMg Co F\n2 2 10\ndirect\n0.534566 0.465434 0.750000 Mg\n0.465435 0.534565 0.250000 Mg\n0.000000 0.000000 0.000000 Co\n0.000000 -0.000000 0.500000 Co\n0.102090 0.897910 0.250000 F\n0.897910 0.102090 0.749999 F\n0.199851 0.285130 0.367184 F\n0.714870 0.800150 0.132816 F\n0.722582 0.327452 0.032464 F\n0.672548 0.277418 0.467536 F\n0.277418 0.672547 0.967535 F\n0.327452 0.722582 0.532464 F\n0.285130 0.199850 0.867184 F\n0.800150 0.714870 0.632815 F\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Mg",
"Co",
"F"
],
"chemical_system": "Co-F-Mg",
"density": 3.7402586590311375,
"density_atomic": 0.08846454707891699,
"volume": 158.25548722372312,
"volume_molar": 6.807405857883159,
"formula_full": "Mg2 Co2 F10",
"formula_reduced": "MgCoF5",
"formula_anonymous": "ABC5",
"energy_above_hull": 0.0,
"spacegroup": 15
}
]
}